1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one

C15H16FNO2 — CID 110635059

IUPAC1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one
SMILESO=C1CCN(C(=O)C2CCCC2)c2ccc(F)cc21
InChIInChI=1S/C15H16FNO2/c16-11-5-6-13-12(9-11)14(18)7-8-17(13)15(19)10-3-1-2-4-10/h5-6,9-10H,1-4,7-8H2
InChIKeyNQADHLIQZLUUNI-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.94
Rot. Bonds1

About 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one

1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one (PubChem CID 110635059) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one.

Molecular Properties

Compound Name1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one
PubChem CID110635059
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one
SMILESO=C1CCN(C(=O)C2CCCC2)c2ccc(F)cc21
InChIInChI=1S/C15H16FNO2/c16-11-5-6-13-12(9-11)14(18)7-8-17(13)15(19)10-3-1-2-4-10/h5-6,9-10H,1-4,7-8H2
InChIKeyNQADHLIQZLUUNI-UHFFFAOYSA-N
XLogP2.94
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclobutanecarbonyl)-6-methoxy-2,3-dihydroquinolin-4-one
CID 110635249
1-(cyclopropanecarbonyl)-6-methyl-2,3-dihydroquinolin-4-one
CID 110634817
2-(6-fluoro-4-oxo-2,3-dihydroquinolin-1-yl)-2-oxoacetic acid
CID 96594062
6-fluoro-4-oxo-N-phenyl-2,3-dihydroquinoline-1-carboxamide
CID 110635094
N,N-diethyl-6-fluoro-4-oxo-2,3-dihydroquinoline-1-carboxamide
CID 110635106
3-(6-fluoro-2,3-dihydroindole-1-carbonyl)cyclohexane-1-carboxylic acid
CID 103953312
(2-aminocycloheptyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103810197
6-fluoro-N-(4-methylphenyl)sulfonyl-4-oxo-2,3-dihydroquinoline-1-carboxamide
CID 110635108
1-(1-cyclohexyl-5-oxopyrrolidine-3-carbonyl)-2,3-dihydroquinolin-4-one
CID 110612523
5-(cyclohexanecarbonyl)-1-methyl-3,4-dihydro-1,5-benzodiazepin-2-one
CID 118740681
methyl 1-(cyclohexanecarbonyl)-2,3-dihydroindole-5-carboxylate
CID 86917335
cyclohexyl-[(5Z)-5-hydroxyimino-3,4-dihydro-2H-1-benzazepin-1-yl]methanone
CID 114337075

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one?
The IUPAC name of 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one (CID 110635059) is 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one.
What is the SMILES notation for 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one?
The canonical SMILES for 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one is O=C1CCN(C(=O)C2CCCC2)c2ccc(F)cc21.
What is the InChIKey of 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one?
The InChIKey is NQADHLIQZLUUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c16-11-5-6-13-12(9-11)14(18)7-8-17(13)15(19)10-3-1-2-4-10/h5-6,9-10H,1-4,7-8H2.
What are the key properties of 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one?
1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one has a molecular weight of 261.30 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentanecarbonyl)-6-fluoro-2,3-dihydroquinolin-4-one is sourced from PubChem (CID 110635059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).