6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one

C12H9F2NO — CID 106520845

IUPAC6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one
SMILESCc1ccc(F)c(-c2cccc(=O)[nH]2)c1F
InChIInChI=1S/C12H9F2NO/c1-7-5-6-8(13)11(12(7)14)9-3-2-4-10(16)15-9/h2-6H,1H3,(H,15,16)
InChIKeyQXJJBLHWZUSSPX-UHFFFAOYSA-N
MW221.21 g/mol
LogP2.63
Rot. Bonds1

About 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one

6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one (PubChem CID 106520845) has the molecular formula C12H9F2NO and a molecular weight of 221.21 g/mol. Its IUPAC name is 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one
PubChem CID106520845
Molecular FormulaC12H9F2NO
Molecular Weight221.21 g/mol
Exact Mass221.07
IUPAC Name6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one
SMILESCc1ccc(F)c(-c2cccc(=O)[nH]2)c1F
InChIInChI=1S/C12H9F2NO/c1-7-5-6-8(13)11(12(7)14)9-3-2-4-10(16)15-9/h2-6H,1H3,(H,15,16)
InChIKeyQXJJBLHWZUSSPX-UHFFFAOYSA-N
XLogP2.63
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.21
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,6-difluoro-3-methylphenyl)-1H-pyridin-4-one
CID 106520830
6-(2,5-difluorophenyl)-1H-pyridin-2-one
CID 53217702
6-[2-fluoro-5-(trifluoromethyl)phenyl]-1H-pyridin-2-one
CID 122358380
1,4-difluoro-5,8-dimethylanthracene-9,10-dione
CID 10890992
4-(2,6-difluoro-3-methylphenyl)-2-propan-2-yl-1H-pyrimidin-6-one
CID 136769942
6-(4-ethoxy-3-fluorophenyl)-1H-pyridin-2-one
CID 122358370
6-[2-(4-chloro-2-methylphenyl)-5-methyl-1,2,4-triazol-3-yl]-1H-pyridin-2-one
CID 50958318
6-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyridin-2-one
CID 135396185
6-(3-methylsulfanylphenyl)-1H-pyridin-2-one
CID 53217784
6-[4-(trifluoromethyl)-2-pyridinyl]-1H-pyridin-2-one
CID 163399751
1-(2,6-difluoro-3-methylphenyl)-2-sulfanylidenepyrimidin-4-one
CID 82819757
6-(4-fluoro-1H-indol-2-yl)-4-methyl-1H-pyridin-2-one
CID 144764054

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one?
The IUPAC name of 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one (CID 106520845) is 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one?
The canonical SMILES for 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one is Cc1ccc(F)c(-c2cccc(=O)[nH]2)c1F.
What is the InChIKey of 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one?
The InChIKey is QXJJBLHWZUSSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2NO/c1-7-5-6-8(13)11(12(7)14)9-3-2-4-10(16)15-9/h2-6H,1H3,(H,15,16).
What are the key properties of 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one?
6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one has a molecular weight of 221.21 g/mol, XLogP of 2.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-difluoro-3-methylphenyl)-1H-pyridin-2-one is sourced from PubChem (CID 106520845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).