N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide

C16H18N2O3 — CID 62517694

IUPACN-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide
SMILESO=C(NC1(CO)CCCC1)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C16H18N2O3/c19-10-16(7-3-4-8-16)18-15(21)12-9-14(20)17-13-6-2-1-5-11(12)13/h1-2,5-6,9,19H,3-4,7-8,10H2,(H,17,20)(H,18,21)
InChIKeyMHGXGSUNCJJNIT-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.56
Rot. Bonds3

About N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide

N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 62517694) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide
PubChem CID62517694
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide
SMILESO=C(NC1(CO)CCCC1)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C16H18N2O3/c19-10-16(7-3-4-8-16)18-15(21)12-9-14(20)17-13-6-2-1-5-11(12)13/h1-2,5-6,9,19H,3-4,7-8,10H2,(H,17,20)(H,18,21)
InChIKeyMHGXGSUNCJJNIT-UHFFFAOYSA-N
XLogP1.56
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(hydroxymethyl)cyclohexyl]-1H-indole-3-carboxamide
CID 62520393
N-[1-(hydroxymethyl)cyclobutyl]-1H-indole-3-carboxamide
CID 115878291
N-[1-(hydroxymethyl)cyclopentyl]-4-oxo-1H-quinoline-3-carboxamide
CID 62519123
N-[(1-aminocyclohexyl)methyl]-2-oxo-1H-quinoline-4-carboxamide;hydrochloride
CID 119404378
2-oxo-1H-quinoline-4-carbohydrazide
CID 676699
N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide
CID 119566050
2-chloro-N-[1-(hydroxymethyl)cyclopentyl]quinoline-4-carboxamide
CID 62517076
N-[1-(hydroxymethyl)cyclobutyl]-1H-indole-4-carboxamide
CID 115878331
N-[(2R)-2-hydroxy-2-phenylethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 28934807
N-[[1-(2-chlorophenyl)cyclohexyl]methyl]-2-oxo-1H-quinoline-4-carboxamide
CID 167855135
N-(2,3-dihydroxy-2-methylpropyl)-2-oxo-1H-quinoline-4-carboxamide
CID 66168370
trans-(1S,2S)-2-[(2-oxo-1H-quinoline-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 124703895

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide (CID 62517694) is N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide is O=C(NC1(CO)CCCC1)c1cc(=O)[nH]c2ccccc12.
What is the InChIKey of N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is MHGXGSUNCJJNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c19-10-16(7-3-4-8-16)18-15(21)12-9-14(20)17-13-6-2-1-5-11(12)13/h1-2,5-6,9,19H,3-4,7-8,10H2,(H,17,20)(H,18,21).
What are the key properties of N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide?
N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 1.56, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 62517694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).