N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide

C16H17FN2O2 — CID 110627525

IUPACN-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(NCC1CCCC1)c1cc2ccc(F)cc2[nH]c1=O
InChIInChI=1S/C16H17FN2O2/c17-12-6-5-11-7-13(16(21)19-14(11)8-12)15(20)18-9-10-3-1-2-4-10/h5-8,10H,1-4,9H2,(H,18,20)(H,19,21)
InChIKeyGKCRFKHCGSLPQF-UHFFFAOYSA-N
MW288.32 g/mol
LogP2.59
Rot. Bonds3

About N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide

N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 110627525) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide
PubChem CID110627525
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC NameN-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(NCC1CCCC1)c1cc2ccc(F)cc2[nH]c1=O
InChIInChI=1S/C16H17FN2O2/c17-12-6-5-11-7-13(16(21)19-14(11)8-12)15(20)18-9-10-3-1-2-4-10/h5-8,10H,1-4,9H2,(H,18,20)(H,19,21)
InChIKeyGKCRFKHCGSLPQF-UHFFFAOYSA-N
XLogP2.59
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-6-fluoro-2-oxo-1H-quinoline-3-carboxamide
CID 155963960
7-fluoro-N-[2-(4-fluorophenyl)-2-oxoethyl]-2-oxo-1H-quinoline-3-carboxamide
CID 110607516
N-[2-[(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl]-7-fluoro-2-oxo-1H-quinoline-3-carboxamide
CID 110605998
2-amino-N-(cyclohexylmethyl)-5-fluorobenzamide
CID 43371580
3-[3-(ethoxymethyl)piperidine-1-carbonyl]-7-fluoro-1H-quinolin-2-one
CID 110610273
N-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-7-fluoro-2-oxo-1H-quinoline-3-carboxamide
CID 110626280
7-fluoro-2-oxo-N-(2-phenoxyethoxy)-1H-quinoline-3-carboxamide
CID 110632933
ethyl 4-[(7-fluoro-2-oxo-1H-quinoline-3-carbonyl)amino]benzoate
CID 110426635
N-cyclopentyl-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110407034
2-(3-aminoprop-1-ynyl)-N-(cyclopentylmethyl)-5-fluorobenzamide
CID 60822341
N-(cyclohexylmethyl)-6-fluoro-1-oxoisochromene-3-carboxamide
CID 172904534
N-(cyclohexylmethyl)-2-(4-fluorophenyl)acetamide
CID 83278373

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide (CID 110627525) is N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide is O=C(NCC1CCCC1)c1cc2ccc(F)cc2[nH]c1=O.
What is the InChIKey of N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is GKCRFKHCGSLPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O2/c17-12-6-5-11-7-13(16(21)19-14(11)8-12)15(20)18-9-10-3-1-2-4-10/h5-8,10H,1-4,9H2,(H,18,20)(H,19,21).
What are the key properties of N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide?
N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 288.32 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-7-fluoro-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 110627525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).