Same Parent, Connectivity for PubChem Compound (Select 139396394) - PubChem Compound - NCBI

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Select item 1393963941.

an image of a chemical structure CID 139396394

SCHEMBL21252711

MW:: 239.310
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[(2S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol

Create Date:: 2019-11-02

CID:: 139396394

Summary Similar Compounds Same Parent, Connectivity

Select item 1694425632.

an image of a chemical structure CID 169442563

MW:: 246.350
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-1-hydroxy...

Create Date:: 2023-12-01

CID:: 169442563

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1316985623.

an image of a chemical structure CID 131698562

MW:: 239.310
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[(1R)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol

Create Date:: 2017-10-23

CID:: 131698562

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 593040314.

an image of a chemical structure CID 59304031

MW:: 239.310
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[(1S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol

Create Date:: 2012-08-20

CID:: 59304031

Summary Similar Compounds Same Parent, Connectivity

Select item 513714665.

an image of a chemical structure CID 51371466

DT6P9Y45WD; Isoetharine, (1R,2R)-(+/-)-; UNII-DT6P9Y45WD ...

MW:: 239.310
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[(1S,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-d...

Create Date:: 2011-05-20

CID:: 51371466

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 66041196.

an image of a chemical structure CID 6604119

UBG54Q2CVT; Isoetharine, (1R,2S)-; UNII-UBG54Q2CVT ...

MW:: 239.310
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[(1R,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-d...

Create Date:: 2006-05-30

CID:: 6604119

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 63213017.

an image of a chemical structure CID 6321301

MW:: 239.310
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[(1R,2R)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-d...

Create Date:: 2005-08-08

CID:: 6321301

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 714668.

an image of a chemical structure CID 71466

Isoetharine [MI]; Isoetarine [INN]; Isoetharine [USAN] ...

MW:: 239.310
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[(1S,2R)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-d...

Create Date:: 2005-06-24

CID:: 71466

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 37629.

an image of a chemical structure CID 3762

isoetharine; Isoetarine; Isoetarin ...

MW:: 239.310
MF:: C₁₃H₂₁NO₃

IUPAC name:: 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol

Create Date:: 2005-03-25

CID:: 3762

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 16944256210.

an image of a chemical structure CID 169442562

Isoetharine-d7 Hydrochloride

MW:: 282.810
MF:: C₁₃H₂₂ClNO₃

IUPAC name:: 4-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-1-hydroxy...

Create Date:: 2023-12-01

CID:: 169442562

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13169856111.

an image of a chemical structure CID 131698561

(R,*)-()-4-[1-hydroxy-2-[(1-methylethyl)amino]butyl]pyroC atecholhydrochloride

MW:: 275.770
MF:: C₁₃H₂₂ClNO₃

IUPAC name:: 4-[(1R)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol...

Create Date:: 2017-10-23

CID:: 131698561

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13163512612.

an image of a chemical structure CID 131635126

5JK0208T9K; UNII-5JK0208T9K; Isoetharine hydrochloride, (1R,2R)-(+/-)- ...

MW:: 275.770
MF:: C₁₃H₂₂ClNO₃

IUPAC name:: 4-[(1S,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-d...

Create Date:: 2017-10-17

CID:: 131635126

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 7697262213.

an image of a chemical structure CID 76972622

Bronkometer; DV74WJ5PJB; 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)-butyl)-, methanesulfonate (salt) ...

MW:: 335.420
MF:: C₁₄H₂₅NO₆S

IUPAC name:: 4-[(1S,2R)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-d...

Create Date:: 2014-08-25

CID:: 76972622

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 7696452314.

an image of a chemical structure CID 76964523

MW:: 275.770
MF:: C₁₃H₂₂ClNO₃

IUPAC name:: 4-[(1R,2S)-1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-d...

Create Date:: 2014-08-25

CID:: 76964523

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 5137429715.

an image of a chemical structure CID 51374297

MW:: 240.320
MF:: C₁₃H₂₂NO₃⁺

IUPAC name:: [(1S,2R)-1-(3,4-dihydroxyphenyl)-1-hydroxybutan-2-yl]-propan...

Create Date:: 2011-05-20

CID:: 51374297

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 5137429616.

an image of a chemical structure CID 51374296

MW:: 240.320
MF:: C₁₃H₂₂NO₃⁺

IUPAC name:: [(1R,2R)-1-(3,4-dihydroxyphenyl)-1-hydroxybutan-2-yl]-propan...

Create Date:: 2011-05-20

CID:: 51374296

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 5137146517.

an image of a chemical structure CID 51371465

MW:: 240.320
MF:: C₁₃H₂₂NO₃⁺

IUPAC name:: [(1S,2S)-1-(3,4-dihydroxyphenyl)-1-hydroxybutan-2-yl]-propan...

Create Date:: 2011-05-20

CID:: 51371465

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 4432922118.

an image of a chemical structure CID 44329221

MW:: 240.320
MF:: C₁₃H₂₂NO₃⁺

IUPAC name:: [(1R,2S)-1-(3,4-dihydroxyphenyl)-1-hydroxybutan-2-yl]-propan...

Create Date:: 2009-11-19

CID:: 44329221

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 2361605719.

an image of a chemical structure CID 23616057

MW:: 371.900
MF:: C₁₄H₂₆ClNO₆S

IUPAC name:: 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;meth...

Create Date:: 2007-12-12

CID:: 23616057

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 2361605620.

an image of a chemical structure CID 23616056

MW:: 312.200
MF:: C₁₃H₂₃Cl₂NO₃

IUPAC name:: 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;dihy...

Create Date:: 2007-12-12

CID:: 23616056

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

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Chemical Properties

Rule of 5 (13)
Compounds satisfied Lipinski's Rule of Five in evaluating druglikeness. Query: (-5:5[LOGP]) AND (0:500[MOLWT]) AND (0:5[HBDC]) AND (0:10[HBAC]).

BioActivity Experiments

BioAssays, Active (3)
Compounds identified as active in screening experiments

BioAssays, Tested (4)
Compounds identified as tested in screening experiments

BioMedical Annotation

Pharmacological Actions (4)
Therapeutic use and National Library of Medicine (NLM) compound classifications

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