1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one

C13H11F2NO — CID 2314953

IUPAC1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one
SMILESCc1cc(=O)cc(C)n1-c1ccc(F)cc1F
InChIInChI=1S/C13H11F2NO/c1-8-5-11(17)6-9(2)16(8)13-4-3-10(14)7-12(13)15/h3-7H,1-2H3
InChIKeyUVEOQBGKTXDWLL-UHFFFAOYSA-N
MW235.23 g/mol
LogP2.73
Rot. Bonds1

About 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one

1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one (PubChem CID 2314953) has the molecular formula C13H11F2NO and a molecular weight of 235.23 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one
PubChem CID2314953
Molecular FormulaC13H11F2NO
Molecular Weight235.23 g/mol
Exact Mass235.08
IUPAC Name1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one
SMILESCc1cc(=O)cc(C)n1-c1ccc(F)cc1F
InChIInChI=1S/C13H11F2NO/c1-8-5-11(17)6-9(2)16(8)13-4-3-10(14)7-12(13)15/h3-7H,1-2H3
InChIKeyUVEOQBGKTXDWLL-UHFFFAOYSA-N
XLogP2.73
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.23
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1-(3-Fluorophenyl)-1H-pyrrole-2,5-dione
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2,2,2-trifluoro-N,N-diphenylacetamide
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3-[(4-Fluorophenyl)amino]cyclohex-2-en-1-one
CID 2748639
2,6-Dimethyl-1-phenyl-4(1H)-pyridone hydrochloride
CID 517812
N-(2,4-difluorophenyl)-N-methylacetamide
CID 2737628
1-(2-aminophenyl)-2,6-dimethyl-4(1H)-pyridinone
CID 977818
3-(2,4-Difluoroanilino)-5,5-dimethyl-1-cyclohex-2-enone
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N-(pentafluorophenyl)-N-phenylacetamide
CID 2268959

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one?
The IUPAC name of 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one (CID 2314953) is 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one?
The canonical SMILES for 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one is Cc1cc(=O)cc(C)n1-c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one?
The InChIKey is UVEOQBGKTXDWLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2NO/c1-8-5-11(17)6-9(2)16(8)13-4-3-10(14)7-12(13)15/h3-7H,1-2H3.
What are the key properties of 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one?
1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one has a molecular weight of 235.23 g/mol, XLogP of 2.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2,6-dimethylpyridin-4-one is sourced from PubChem (CID 2314953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).