1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one

C16H12FNO2 — CID 54679723

IUPAC1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one
SMILESO=c1cc(O)c2ccccc2n1Cc1ccccc1F
InChIInChI=1S/C16H12FNO2/c17-13-7-3-1-5-11(13)10-18-14-8-4-2-6-12(14)15(19)9-16(18)20/h1-9,19H,10H2
InChIKeyAOPFLEHHPJSBPC-UHFFFAOYSA-N
MW269.28 g/mol
LogP2.89
Rot. Bonds2

About 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one

1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one (PubChem CID 54679723) has the molecular formula C16H12FNO2 and a molecular weight of 269.28 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one
PubChem CID54679723
Molecular FormulaC16H12FNO2
Molecular Weight269.28 g/mol
Exact Mass269.09
IUPAC Name1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one
SMILESO=c1cc(O)c2ccccc2n1Cc1ccccc1F
InChIInChI=1S/C16H12FNO2/c17-13-7-3-1-5-11(13)10-18-14-8-4-2-6-12(14)15(19)9-16(18)20/h1-9,19H,10H2
InChIKeyAOPFLEHHPJSBPC-UHFFFAOYSA-N
XLogP2.89
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one?
The IUPAC name of 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one (CID 54679723) is 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one is O=c1cc(O)c2ccccc2n1Cc1ccccc1F.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one?
The InChIKey is AOPFLEHHPJSBPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO2/c17-13-7-3-1-5-11(13)10-18-14-8-4-2-6-12(14)15(19)9-16(18)20/h1-9,19H,10H2.
What are the key properties of 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one?
1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one has a molecular weight of 269.28 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]-4-hydroxyquinolin-2-one is sourced from PubChem (CID 54679723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).