N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide

C16H18FN3O2 — CID 119566050

IUPACN-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide
SMILESNCC1(NC(=O)c2cc(=O)[nH]c3cc(F)ccc23)CCCC1
InChIInChI=1S/C16H18FN3O2/c17-10-3-4-11-12(8-14(21)19-13(11)7-10)15(22)20-16(9-18)5-1-2-6-16/h3-4,7-8H,1-2,5-6,9,18H2,(H,19,21)(H,20,22)
InChIKeyLCAYEUZCNZPOSI-UHFFFAOYSA-N
MW303.34 g/mol
LogP1.67
Rot. Bonds3

About N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide

N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 119566050) has the molecular formula C16H18FN3O2 and a molecular weight of 303.34 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide
PubChem CID119566050
Molecular FormulaC16H18FN3O2
Molecular Weight303.34 g/mol
Exact Mass303.14
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide
SMILESNCC1(NC(=O)c2cc(=O)[nH]c3cc(F)ccc23)CCCC1
InChIInChI=1S/C16H18FN3O2/c17-10-3-4-11-12(8-14(21)19-13(11)7-10)15(22)20-16(9-18)5-1-2-6-16/h3-4,7-8H,1-2,5-6,9,18H2,(H,19,21)(H,20,22)
InChIKeyLCAYEUZCNZPOSI-UHFFFAOYSA-N
XLogP1.67
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.34
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[1-(aminomethyl)cyclopentyl]-7-fluoro-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-(aminomethyl)cyclopentyl]-4-fluorobenzamide
CID 63753788
N-[1-(hydroxymethyl)cyclopentyl]-2-oxo-1H-quinoline-4-carboxamide
CID 62517694
N-[1-(aminomethyl)cyclopentyl]-4-fluorobenzamide;hydrochloride
CID 119567161
N-(2-amino-2-ethylbutyl)-7-fluoro-2-oxo-1H-quinoline-4-carboxamide
CID 119641077
N-[1-(aminomethyl)cyclopentyl]-3-fluorobenzamide
CID 16740505
N-[1-(aminomethyl)cyclopentyl]-6-fluoro-1H-benzimidazole-4-carboxamide;dihydrochloride
CID 119564817
7-fluoro-N-(2-hydroxy-2,3-dimethylbutyl)-2-oxo-1H-quinoline-4-carboxamide
CID 111484288
ethyl 7-fluoro-2-oxo-1H-quinoline-4-carboxylate
CID 162422252
N-[1-(aminomethyl)cyclohexyl]-3,5-difluorobenzamide
CID 63755319
7-fluoro-N-(oxan-2-ylmethyl)-2-oxo-1H-quinoline-4-carboxamide
CID 121495129
4-(azocane-1-carbonyl)-7-fluoro-1H-quinolin-2-one
CID 71874791
7-fluoro-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-2-oxo-1H-quinoline-4-carboxamide
CID 111696910

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide (CID 119566050) is N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide is NCC1(NC(=O)c2cc(=O)[nH]c3cc(F)ccc23)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is LCAYEUZCNZPOSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O2/c17-10-3-4-11-12(8-14(21)19-13(11)7-10)15(22)20-16(9-18)5-1-2-6-16/h3-4,7-8H,1-2,5-6,9,18H2,(H,19,21)(H,20,22).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide?
N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 303.34 g/mol, XLogP of 1.67, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-7-fluoro-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 119566050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).