1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one

C16H12FNO2 — CID 54716015

IUPAC1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one
SMILESCc1c(O)c2ccccc2n(-c2ccccc2F)c1=O
InChIInChI=1S/C16H12FNO2/c1-10-15(19)11-6-2-4-8-13(11)18(16(10)20)14-9-5-3-7-12(14)17/h2-9,19H,1H3
InChIKeyMUAPYXFLLZJUOP-UHFFFAOYSA-N
MW269.28 g/mol
LogP3.14
Rot. Bonds1

About 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one

1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one (PubChem CID 54716015) has the molecular formula C16H12FNO2 and a molecular weight of 269.28 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one.

Molecular Properties

Compound Name1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one
PubChem CID54716015
Molecular FormulaC16H12FNO2
Molecular Weight269.28 g/mol
Exact Mass269.09
IUPAC Name1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one
SMILESCc1c(O)c2ccccc2n(-c2ccccc2F)c1=O
InChIInChI=1S/C16H12FNO2/c1-10-15(19)11-6-2-4-8-13(11)18(16(10)20)14-9-5-3-7-12(14)17/h2-9,19H,1H3
InChIKeyMUAPYXFLLZJUOP-UHFFFAOYSA-N
XLogP3.14
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one?
The IUPAC name of 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one (CID 54716015) is 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one.
What is the SMILES notation for 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one?
The canonical SMILES for 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one is Cc1c(O)c2ccccc2n(-c2ccccc2F)c1=O.
What is the InChIKey of 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one?
The InChIKey is MUAPYXFLLZJUOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO2/c1-10-15(19)11-6-2-4-8-13(11)18(16(10)20)14-9-5-3-7-12(14)17/h2-9,19H,1H3.
What are the key properties of 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one?
1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one has a molecular weight of 269.28 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-4-hydroxy-3-methylquinolin-2-one is sourced from PubChem (CID 54716015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).