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

C16H18FNO2 — CID 104751280

IUPAC1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one
SMILESO=C(CN1C(=O)CCc2cc(F)ccc21)C1CCCC1
InChIInChI=1S/C16H18FNO2/c17-13-6-7-14-12(9-13)5-8-16(20)18(14)10-15(19)11-3-1-2-4-11/h6-7,9,11H,1-5,8,10H2
InChIKeyCWKPCULSOQTACJ-UHFFFAOYSA-N
MW275.32 g/mol
LogP2.86
Rot. Bonds3

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

1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one (PubChem CID 104751280) has the molecular formula C16H18FNO2 and a molecular weight of 275.32 g/mol. Its IUPAC name is 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one
PubChem CID104751280
Molecular FormulaC16H18FNO2
Molecular Weight275.32 g/mol
Exact Mass275.13
IUPAC Name1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one
SMILESO=C(CN1C(=O)CCc2cc(F)ccc21)C1CCCC1
InChIInChI=1S/C16H18FNO2/c17-13-6-7-14-12(9-13)5-8-16(20)18(14)10-15(19)11-3-1-2-4-11/h6-7,9,11H,1-5,8,10H2
InChIKeyCWKPCULSOQTACJ-UHFFFAOYSA-N
XLogP2.86
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.32
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one with MolForge

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Related Compounds

1-[3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)propanoyl]piperidine-3-carboxylic acid
CID 119033231
1-(2-cyclohexyl-2-oxoethyl)-6-fluoroindole-2,3-dione
CID 104751180
ethyl 4-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-3-oxobutanoate
CID 63899076
6-fluoro-1-(2-piperidin-2-ylethyl)-3,4-dihydroquinolin-2-one
CID 61345345
5-fluoro-1-(2-oxo-2-piperidin-1-ylethyl)-3H-indol-2-one
CID 155958104
6-fluoro-1-(2-hydroxy-3-methylbutyl)-3,4-dihydroquinolin-2-one
CID 114249768
2-[cyclopropyl-[3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)propanoyl]amino]acetic acid
CID 119195279
1-[[1-(bromomethyl)cyclobutyl]methyl]-6-fluoro-3,4-dihydroquinolin-2-one
CID 65007723
N-(2,4-difluorophenyl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
CID 126458852
1-[2-(4-aminophenyl)ethyl]-6-fluoro-3,4-dihydroquinolin-2-one
CID 43519642
6-methylsulfanyl-1-(2-oxopropyl)-3,4-dihydroquinolin-2-one
CID 139885156
3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]propanamide
CID 111696915

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one (CID 104751280) is 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one is O=C(CN1C(=O)CCc2cc(F)ccc21)C1CCCC1.
What is the InChIKey of 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one?
The InChIKey is CWKPCULSOQTACJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO2/c17-13-6-7-14-12(9-13)5-8-16(20)18(14)10-15(19)11-3-1-2-4-11/h6-7,9,11H,1-5,8,10H2.
What are the key properties of 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one?
1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one has a molecular weight of 275.32 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentyl-2-oxoethyl)-6-fluoro-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 104751280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).