N-(2-hydroxypropyl)-1H-indole-4-carboxamide

C12H14N2O2 — CID 43501200

IUPACN-(2-hydroxypropyl)-1H-indole-4-carboxamide
SMILESCC(O)CNC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C12H14N2O2/c1-8(15)7-14-12(16)10-3-2-4-11-9(10)5-6-13-11/h2-6,8,13,15H,7H2,1H3,(H,14,16)
InChIKeyVPBQOXPGRKPXHB-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.28
Rot. Bonds3

About N-(2-hydroxypropyl)-1H-indole-4-carboxamide

N-(2-hydroxypropyl)-1H-indole-4-carboxamide (PubChem CID 43501200) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-1H-indole-4-carboxamide
PubChem CID43501200
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC NameN-(2-hydroxypropyl)-1H-indole-4-carboxamide
SMILESCC(O)CNC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C12H14N2O2/c1-8(15)7-14-12(16)10-3-2-4-11-9(10)5-6-13-11/h2-6,8,13,15H,7H2,1H3,(H,14,16)
InChIKeyVPBQOXPGRKPXHB-UHFFFAOYSA-N
XLogP1.28
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methyl-2-propan-2-ylbutyl)-1H-indole-4-carboxamide
CID 102907617
N-(2-methyl-3-methylsulfanylpropyl)-1H-indole-4-carboxamide
CID 63960321
methyl 2-hydroxy-3-(1H-indole-4-carbonylamino)propanoate
CID 103957814
N-(3-ethyl-2-hydroxypentyl)-1H-indole-4-carboxamide
CID 103723441
N-(2-aminobutyl)-1H-indole-4-carboxamide
CID 63733452
N-[2-(2-methylpropylamino)-2-oxoethyl]-1H-indole-4-carboxamide
CID 115672235
N-(2,2-diethoxyethyl)-1H-indole-4-carboxamide
CID 79548414
N-[(2S)-2-hydroxypropyl]-1H-indole-7-carboxamide
CID 83030773
N-(4-hydroxybutan-2-yl)-1H-indole-4-carboxamide
CID 81043314
1H-indole-4-carbohydrazide
CID 43316644
N-(3-propan-2-yloxypropyl)-1H-indole-4-carboxamide
CID 60865335
N-[3-[methyl(propan-2-yl)amino]propyl]-1H-indole-4-carboxamide
CID 103721268

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-1H-indole-4-carboxamide?
The IUPAC name of N-(2-hydroxypropyl)-1H-indole-4-carboxamide (CID 43501200) is N-(2-hydroxypropyl)-1H-indole-4-carboxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-1H-indole-4-carboxamide?
The canonical SMILES for N-(2-hydroxypropyl)-1H-indole-4-carboxamide is CC(O)CNC(=O)c1cccc2[nH]ccc12.
What is the InChIKey of N-(2-hydroxypropyl)-1H-indole-4-carboxamide?
The InChIKey is VPBQOXPGRKPXHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-8(15)7-14-12(16)10-3-2-4-11-9(10)5-6-13-11/h2-6,8,13,15H,7H2,1H3,(H,14,16).
What are the key properties of N-(2-hydroxypropyl)-1H-indole-4-carboxamide?
N-(2-hydroxypropyl)-1H-indole-4-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 1.28, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-1H-indole-4-carboxamide is sourced from PubChem (CID 43501200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).