1-(2-hydroxyethyl)indole-3-carboxamide

C11H12N2O2 — CID 172792494

IUPAC1-(2-hydroxyethyl)indole-3-carboxamide
SMILESNC(=O)c1cn(CCO)c2ccccc12
InChIInChI=1S/C11H12N2O2/c12-11(15)9-7-13(5-6-14)10-4-2-1-3-8(9)10/h1-4,7,14H,5-6H2,(H2,12,15)
InChIKeyPTJPJCRQICROQZ-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.73
Rot. Bonds3

About 1-(2-hydroxyethyl)indole-3-carboxamide

1-(2-hydroxyethyl)indole-3-carboxamide (PubChem CID 172792494) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)indole-3-carboxamide.

Molecular Properties

Compound Name1-(2-hydroxyethyl)indole-3-carboxamide
PubChem CID172792494
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name1-(2-hydroxyethyl)indole-3-carboxamide
SMILESNC(=O)c1cn(CCO)c2ccccc12
InChIInChI=1S/C11H12N2O2/c12-11(15)9-7-13(5-6-14)10-4-2-1-3-8(9)10/h1-4,7,14H,5-6H2,(H2,12,15)
InChIKeyPTJPJCRQICROQZ-UHFFFAOYSA-N
XLogP0.73
TPSA68.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2-hydroxyethyl)indol-3-yl]-2-oxoacetamide
CID 20976467
1-(2-hydroxyethyl)-5-methylindole-3-carboxamide
CID 173096651
1-[(4-bromophenyl)methyl]indole-3-carboxamide
CID 91690104
2-(1-dodecylindol-3-yl)-2-oxoacetamide
CID 174644392
[1-(4-hydroxybutyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 11580465
1-[2-[(3aS,7aR)-1,3,3a,4,7,7a-hexahydroisoindol-2-yl]-2-oxoethyl]indole-3-carboxamide
CID 56878336
1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]indole-3-carboxamide
CID 47059443
1-[3-[4-(oxolan-2-ylmethyl)piperazin-1-yl]propyl]indole-3-carboxamide
CID 143503064
2-[3-(2,2,2-trifluoroacetyl)indol-1-yl]acetamide
CID 2174755
4-[1-(3-carboxypropyl)indol-3-yl]-4-oxobutanoic acid
CID 22400520
1-(2-ethylsulfonylethyl)indole-3-carboxylic acid
CID 43807959
1-(carboxymethyl)indole-3-carboxylic acid
CID 14914502

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)indole-3-carboxamide?
The IUPAC name of 1-(2-hydroxyethyl)indole-3-carboxamide (CID 172792494) is 1-(2-hydroxyethyl)indole-3-carboxamide.
What is the SMILES notation for 1-(2-hydroxyethyl)indole-3-carboxamide?
The canonical SMILES for 1-(2-hydroxyethyl)indole-3-carboxamide is NC(=O)c1cn(CCO)c2ccccc12.
What is the InChIKey of 1-(2-hydroxyethyl)indole-3-carboxamide?
The InChIKey is PTJPJCRQICROQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c12-11(15)9-7-13(5-6-14)10-4-2-1-3-8(9)10/h1-4,7,14H,5-6H2,(H2,12,15).
What are the key properties of 1-(2-hydroxyethyl)indole-3-carboxamide?
1-(2-hydroxyethyl)indole-3-carboxamide has a molecular weight of 204.23 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)indole-3-carboxamide is sourced from PubChem (CID 172792494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).