4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide

C16H19N3O2 — CID 103856999

IUPAC4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide
SMILESNc1cc(C(=O)NC2CCCC2CO)nc2ccccc12
InChIInChI=1S/C16H19N3O2/c17-12-8-15(18-14-6-2-1-5-11(12)14)16(21)19-13-7-3-4-10(13)9-20/h1-2,5-6,8,10,13,20H,3-4,7,9H2,(H2,17,18)(H,19,21)
InChIKeyCYJPZUQHXFIPSG-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.71
Rot. Bonds3

About 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide

4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide (PubChem CID 103856999) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide
PubChem CID103856999
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide
SMILESNc1cc(C(=O)NC2CCCC2CO)nc2ccccc12
InChIInChI=1S/C16H19N3O2/c17-12-8-15(18-14-6-2-1-5-11(12)14)16(21)19-13-7-3-4-10(13)9-20/h1-2,5-6,8,10,13,20H,3-4,7,9H2,(H2,17,18)(H,19,21)
InChIKeyCYJPZUQHXFIPSG-UHFFFAOYSA-N
XLogP1.71
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-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

4-amino-N-piperidin-4-ylquinoline-2-carboxamide
CID 71141710
4-amino-N-cyclopentyloxyquinoline-2-carboxamide
CID 83216868
N-[2-(hydroxymethyl)cyclopentyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 103751269
[2-[(2-aminoquinazolin-4-yl)amino]cyclopentyl]methanol
CID 106368086
4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
CID 103827378
N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 85447885
2-amino-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 103951112
4-amino-N-(2-cyclopropyl-2-hydroxyethyl)quinoline-2-carboxamide
CID 115485639
N-[2-(aminomethyl)cyclopentyl]quinoxaline-2-carboxamide;dihydrochloride
CID 119600664
4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide
CID 103099401
[2-[(2-aminoquinazolin-4-yl)amino]cyclohexyl]methanol
CID 106368258
4-amino-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 113266858

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide?
The IUPAC name of 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide (CID 103856999) is 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide?
The canonical SMILES for 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide is Nc1cc(C(=O)NC2CCCC2CO)nc2ccccc12.
What is the InChIKey of 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide?
The InChIKey is CYJPZUQHXFIPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c17-12-8-15(18-14-6-2-1-5-11(12)14)16(21)19-13-7-3-4-10(13)9-20/h1-2,5-6,8,10,13,20H,3-4,7,9H2,(H2,17,18)(H,19,21).
What are the key properties of 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide?
4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.71, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide is sourced from PubChem (CID 103856999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).