6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one

C24H17F2NO — CID 155775355

IUPAC6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one
SMILESO=c1c(-c2ccccc2)c(-c2ccccc2)cc(C(F)F)n1-c1ccccc1
InChIInChI=1S/C24H17F2NO/c25-23(26)21-16-20(17-10-4-1-5-11-17)22(18-12-6-2-7-13-18)24(28)27(21)19-14-8-3-9-15-19/h1-16,23H
InChIKeyODUHKXCNNVWZKV-UHFFFAOYSA-N
MW373.40 g/mol
LogP6.11
Rot. Bonds4

About 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one

6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one (PubChem CID 155775355) has the molecular formula C24H17F2NO and a molecular weight of 373.40 g/mol. Its IUPAC name is 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one.

Molecular Properties

Compound Name6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one
PubChem CID155775355
Molecular FormulaC24H17F2NO
Molecular Weight373.40 g/mol
Exact Mass373.13
IUPAC Name6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one
SMILESO=c1c(-c2ccccc2)c(-c2ccccc2)cc(C(F)F)n1-c1ccccc1
InChIInChI=1S/C24H17F2NO/c25-23(26)21-16-20(17-10-4-1-5-11-17)22(18-12-6-2-7-13-18)24(28)27(21)19-14-8-3-9-15-19/h1-16,23H
InChIKeyODUHKXCNNVWZKV-UHFFFAOYSA-N
XLogP6.11
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.40
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-diphenylbicyclo[3.1.0]hexa-1(6),2,4-triene
CID 19931086
1,2,6-triphenylpyridin-4-one
CID 13088641
1-(4-chlorophenyl)-N-cyclohexyl-6-oxo-4,5-diphenylpyridine-2-carboxamide
CID 10950969
5-ethyl-4-hydroxy-1,3,6-triphenylpyridin-2-one
CID 54686582
5-benzoyl-4-hydroxy-1,3,6-triphenylpyridin-2-one
CID 54695653
4-hydroxy-1,3-diphenyl-6-pyridin-3-ylpyridin-2-one
CID 54690659
3-amino-7-nitro-2,4-diphenylisoquinolin-1-one
CID 15696009
9-oxo-1,4-diphenylfluorene-3-carboxylic acid
CID 141295557
4,5-diphenyl-2-propan-2-ylpyridazin-3-one
CID 59302442
1,6-dimethyl-4,5-diphenylpyridin-2-one
CID 165356437
methane;1,2,3,4,5-pentakis-phenylbenzene;1,2,4,5-tetraphenylbenzene
CID 161142859
1,4,6-triphenylpyridin-2-one
CID 629600

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one?
The IUPAC name of 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one (CID 155775355) is 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one.
What is the SMILES notation for 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one?
The canonical SMILES for 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one is O=c1c(-c2ccccc2)c(-c2ccccc2)cc(C(F)F)n1-c1ccccc1.
What is the InChIKey of 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one?
The InChIKey is ODUHKXCNNVWZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F2NO/c25-23(26)21-16-20(17-10-4-1-5-11-17)22(18-12-6-2-7-13-18)24(28)27(21)19-14-8-3-9-15-19/h1-16,23H.
What are the key properties of 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one?
6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one has a molecular weight of 373.40 g/mol, XLogP of 6.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-1,3,4-triphenylpyridin-2-one is sourced from PubChem (CID 155775355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).