2-cyclopentyl-7-fluoro-1H-quinolin-4-one

C14H14FNO — CID 113390333

IUPAC2-cyclopentyl-7-fluoro-1H-quinolin-4-one
SMILESO=c1cc(C2CCCC2)[nH]c2cc(F)ccc12
InChIInChI=1S/C14H14FNO/c15-10-5-6-11-13(7-10)16-12(8-14(11)17)9-3-1-2-4-9/h5-9H,1-4H2,(H,16,17)
InChIKeyKJFUZHUMSLLWKU-UHFFFAOYSA-N
MW231.27 g/mol
LogP3.32
Rot. Bonds1

About 2-cyclopentyl-7-fluoro-1H-quinolin-4-one

2-cyclopentyl-7-fluoro-1H-quinolin-4-one (PubChem CID 113390333) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is 2-cyclopentyl-7-fluoro-1H-quinolin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-7-fluoro-1H-quinolin-4-one
PubChem CID113390333
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name2-cyclopentyl-7-fluoro-1H-quinolin-4-one
SMILESO=c1cc(C2CCCC2)[nH]c2cc(F)ccc12
InChIInChI=1S/C14H14FNO/c15-10-5-6-11-13(7-10)16-12(8-14(11)17)9-3-1-2-4-9/h5-9H,1-4H2,(H,16,17)
InChIKeyKJFUZHUMSLLWKU-UHFFFAOYSA-N
XLogP3.32
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-cyclopentyl-7-fluoro-1H-quinolin-4-one 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

2-bromo-7-fluoro-1H-quinolin-4-one
CID 133056060
7-fluoro-4-oxo-1H-quinoline-2-carbaldehyde
CID 91619062
7-fluoro-2-(methoxymethyl)-1H-quinolin-4-one
CID 103996038
2-cyclopropyl-6-(difluoromethoxy)-1H-quinolin-4-one
CID 63358135
7-fluoro-2-(2-fluorophenyl)-1H-quinolin-4-one
CID 123702147
methyl 4-(cyclohexylamino)-7-fluoro-2-oxo-1H-quinoline-3-carboxylate
CID 97032569
6-fluoro-2-(1-methylpiperidin-4-yl)-1H-indole;hydrobromide
CID 18797198
2-cyclopentyl-6-fluoro-3H-quinazolin-4-one
CID 137190164
6-fluoro-3-methyl-2-piperidin-2-yl-1H-indole
CID 84627006
2-cyclopropyl-6-(2,2,2-trifluoroethoxy)-1H-quinolin-4-one
CID 63357998
2-cyclopropyl-5,8-difluoro-1H-quinolin-4-one
CID 63357690
5-cyclopropyl-4H-thieno[3,2-b]pyridin-7-one
CID 66350432

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-7-fluoro-1H-quinolin-4-one?
The IUPAC name of 2-cyclopentyl-7-fluoro-1H-quinolin-4-one (CID 113390333) is 2-cyclopentyl-7-fluoro-1H-quinolin-4-one.
What is the SMILES notation for 2-cyclopentyl-7-fluoro-1H-quinolin-4-one?
The canonical SMILES for 2-cyclopentyl-7-fluoro-1H-quinolin-4-one is O=c1cc(C2CCCC2)[nH]c2cc(F)ccc12.
What is the InChIKey of 2-cyclopentyl-7-fluoro-1H-quinolin-4-one?
The InChIKey is KJFUZHUMSLLWKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c15-10-5-6-11-13(7-10)16-12(8-14(11)17)9-3-1-2-4-9/h5-9H,1-4H2,(H,16,17).
What are the key properties of 2-cyclopentyl-7-fluoro-1H-quinolin-4-one?
2-cyclopentyl-7-fluoro-1H-quinolin-4-one has a molecular weight of 231.27 g/mol, XLogP of 3.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-7-fluoro-1H-quinolin-4-one is sourced from PubChem (CID 113390333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).