3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one

C15H16FNO2 — CID 90231853

IUPAC3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one
SMILESCC(C)Cc1cc(O)c(-c2ccccc2F)c(=O)[nH]1
InChIInChI=1S/C15H16FNO2/c1-9(2)7-10-8-13(18)14(15(19)17-10)11-5-3-4-6-12(11)16/h3-6,8-9H,7H2,1-2H3,(H2,17,18,19)
InChIKeyJQJKDKJGKLFYMW-UHFFFAOYSA-N
MW261.30 g/mol
LogP3.09
Rot. Bonds3

About 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one

3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one (PubChem CID 90231853) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one
PubChem CID90231853
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one
SMILESCC(C)Cc1cc(O)c(-c2ccccc2F)c(=O)[nH]1
InChIInChI=1S/C15H16FNO2/c1-9(2)7-10-8-13(18)14(15(19)17-10)11-5-3-4-6-12(11)16/h3-6,8-9H,7H2,1-2H3,(H2,17,18,19)
InChIKeyJQJKDKJGKLFYMW-UHFFFAOYSA-N
XLogP3.09
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one?
The IUPAC name of 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one (CID 90231853) is 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one?
The canonical SMILES for 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one is CC(C)Cc1cc(O)c(-c2ccccc2F)c(=O)[nH]1.
What is the InChIKey of 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one?
The InChIKey is JQJKDKJGKLFYMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c1-9(2)7-10-8-13(18)14(15(19)17-10)11-5-3-4-6-12(11)16/h3-6,8-9H,7H2,1-2H3,(H2,17,18,19).
What are the key properties of 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one?
3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one has a molecular weight of 261.30 g/mol, XLogP of 3.09, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-4-hydroxy-6-(2-methylpropyl)-1H-pyridin-2-one is sourced from PubChem (CID 90231853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).