1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one

C18H12F3NO2 — CID 71452217

IUPAC1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one
SMILESO=c1cc(-c2ccc(C(F)(F)F)cc2)cc(-c2ccccc2)n1O
InChIInChI=1S/C18H12F3NO2/c19-18(20,21)15-8-6-12(7-9-15)14-10-16(22(24)17(23)11-14)13-4-2-1-3-5-13/h1-11,24H
InChIKeyOAPXMARAIVEYNC-UHFFFAOYSA-N
MW331.29 g/mol
LogP4.44
Rot. Bonds2

About 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one

1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one (PubChem CID 71452217) has the molecular formula C18H12F3NO2 and a molecular weight of 331.29 g/mol. Its IUPAC name is 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one.

Molecular Properties

Compound Name1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one
PubChem CID71452217
Molecular FormulaC18H12F3NO2
Molecular Weight331.29 g/mol
Exact Mass331.08
IUPAC Name1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one
SMILESO=c1cc(-c2ccc(C(F)(F)F)cc2)cc(-c2ccccc2)n1O
InChIInChI=1S/C18H12F3NO2/c19-18(20,21)15-8-6-12(7-9-15)14-10-16(22(24)17(23)11-14)13-4-2-1-3-5-13/h1-11,24H
InChIKeyOAPXMARAIVEYNC-UHFFFAOYSA-N
XLogP4.44
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.29
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

2(1H)-Pyridinone, 1-hydroxy-4,6-diphenyl-
CID 4370641
6-phenyl-4-methyl-1-hydroxypyridin-2(1H)-one
CID 13590965
1-Hydroxy-4-methyl-6-[(3-phenylphenyl)methyl]pyridin-2-one
CID 118717085
1-Hydroxy-4-methyl-6-(4-phenylphenyl)pyridin-2-one
CID 132961588
1-Hydroxy-4-methyl-6-[4-(2-methylphenyl)phenyl]pyridin-2-one
CID 132961589
6-[4-(4-Tert-butylphenyl)phenyl]-1-hydroxy-4-methylpyridin-2-one
CID 132961590
1-Hydroxy-4-methyl-6-(3-phenylphenyl)pyridin-2-one
CID 134150090
1-Hydroxy-4-methyl-6-[(2-phenylphenyl)methyl]pyridin-2-one
CID 168269956
1-Hydroxy-4-methyl-6-[(4-phenylphenyl)methyl]pyridin-2-one
CID 168279048
6-Cyclohexyl-1-hydroxy-4-phenylpyridin-2-one
CID 168281422
6-(cyclohexylmethyl)-1-hydroxy-4-[(E)-2-phenylethenyl]pyridin-2-one
CID 168289461
6-(Cyclohexylmethyl)-1-hydroxy-4-phenylpyridin-2-one
CID 168292144

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one?
The IUPAC name of 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one (CID 71452217) is 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one.
What is the SMILES notation for 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one?
The canonical SMILES for 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one is O=c1cc(-c2ccc(C(F)(F)F)cc2)cc(-c2ccccc2)n1O.
What is the InChIKey of 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one?
The InChIKey is OAPXMARAIVEYNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3NO2/c19-18(20,21)15-8-6-12(7-9-15)14-10-16(22(24)17(23)11-14)13-4-2-1-3-5-13/h1-11,24H.
What are the key properties of 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one?
1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one has a molecular weight of 331.29 g/mol, XLogP of 4.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-6-phenyl-4-[4-(trifluoromethyl)phenyl]pyridin-2-one is sourced from PubChem (CID 71452217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).