6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one

C16H11F2NO — CID 131850823

IUPAC6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one
SMILESCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc2c1=O
InChIInChI=1S/C16H11F2NO/c1-9-15(10-2-4-11(17)5-3-10)19-14-7-6-12(18)8-13(14)16(9)20/h2-8H,1H3,(H,19,20)
InChIKeyIZTJFOBLHZYCFG-UHFFFAOYSA-N
MW271.27 g/mol
LogP3.78
Rot. Bonds1

About 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one

6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one (PubChem CID 131850823) has the molecular formula C16H11F2NO and a molecular weight of 271.27 g/mol. Its IUPAC name is 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one.

Molecular Properties

Compound Name6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one
PubChem CID131850823
Molecular FormulaC16H11F2NO
Molecular Weight271.27 g/mol
Exact Mass271.08
IUPAC Name6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one
SMILESCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc2c1=O
InChIInChI=1S/C16H11F2NO/c1-9-15(10-2-4-11(17)5-3-10)19-14-7-6-12(18)8-13(14)16(9)20/h2-8H,1H3,(H,19,20)
InChIKeyIZTJFOBLHZYCFG-UHFFFAOYSA-N
XLogP3.78
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-chloro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one
CID 131850822
3,8-dimethyl-2,7-bis(4-methylphenyl)-1,6-dihydropyrido[2,3-g]quinoline-4,9-dione
CID 139781792
2-(4-tert-butyl-2-methylphenyl)-6-fluoro-3-methyl-1H-quinolin-4-one
CID 169256709
2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione
CID 58939138
6-fluoro-8-iodo-3-methyl-2-phenyl-1H-quinolin-4-one
CID 104845949
6-fluoro-3-methyl-9H-carbazole-1,4-dione
CID 14831887
5-fluoro-3-methyl-1H-indole-2-carboxylic acid
CID 1132967
6-fluoro-3-methyl-2-[6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyrazin-2-yl]-1H-quinolin-4-one
CID 165401337
methyl 2-(4-bromophenyl)-5-fluoro-1H-indole-3-carboxylate
CID 172606531
(6-fluoro-2-methyl-4-oxo-1H-quinolin-3-yl)methyl-dipropylazanium
CID 3557128
2-(6-fluoro-2-methyl-4-oxo-1H-quinolin-3-yl)acetonitrile
CID 82241864
2-(4-fluorophenyl)-3-phenyl-1H-quinolin-4-one
CID 19067574

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one?
The IUPAC name of 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one (CID 131850823) is 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one.
What is the SMILES notation for 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one?
The canonical SMILES for 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one is Cc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc2c1=O.
What is the InChIKey of 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one?
The InChIKey is IZTJFOBLHZYCFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2NO/c1-9-15(10-2-4-11(17)5-3-10)19-14-7-6-12(18)8-13(14)16(9)20/h2-8H,1H3,(H,19,20).
What are the key properties of 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one?
6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one has a molecular weight of 271.27 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(4-fluorophenyl)-3-methyl-1H-quinolin-4-one is sourced from PubChem (CID 131850823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).