6-(difluoromethyl)-4-methyl-1H-pyridin-2-one

C7H7F2NO — CID 10103416

IUPAC6-(difluoromethyl)-4-methyl-1H-pyridin-2-one
SMILESCc1cc(C(F)F)[nH]c(=O)c1
InChIInChI=1S/C7H7F2NO/c1-4-2-5(7(8)9)10-6(11)3-4/h2-3,7H,1H3,(H,10,11)
InChIKeyXNGLBBQBRDGDJF-UHFFFAOYSA-N
MW159.13 g/mol
LogP1.62
Rot. Bonds1

About 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one

6-(difluoromethyl)-4-methyl-1H-pyridin-2-one (PubChem CID 10103416) has the molecular formula C7H7F2NO and a molecular weight of 159.13 g/mol. Its IUPAC name is 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(difluoromethyl)-4-methyl-1H-pyridin-2-one
PubChem CID10103416
Molecular FormulaC7H7F2NO
Molecular Weight159.13 g/mol
Exact Mass159.05
IUPAC Name6-(difluoromethyl)-4-methyl-1H-pyridin-2-one
SMILESCc1cc(C(F)F)[nH]c(=O)c1
InChIInChI=1S/C7H7F2NO/c1-4-2-5(7(8)9)10-6(11)3-4/h2-3,7H,1H3,(H,10,11)
InChIKeyXNGLBBQBRDGDJF-UHFFFAOYSA-N
XLogP1.62
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.13
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-Methyl-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile
CID 247440
6-Methyl-4-(trifluoromethyl)pyridin-2(1H)-one
CID 2782992
4,6-Dimethylpyridin-2-ol
CID 226288
5-Amino-4,6-dimethylpyridin-2(1H)-one
CID 23008633
4-(3-chloro-1,1,2,2,3,3-hexafluoropropyl)-6-methyl-1H-pyridin-2-one
CID 10935260
4-Methyl-6-(trifluoromethyl)pyridin-2(1H)-one
CID 10035141
4-methyl-6-(1,1,2,2,2-pentafluoroethyl)-1H-pyridin-2-one
CID 10105131
4,6-Bis(trifluoromethyl)pyridin-2(1H)-one
CID 13148079
3,6-dimethyl-4-(trifluoromethyl)-1H-pyridin-2-one
CID 15210459
5,6-dimethyl-3-(trifluoromethyl)-1H-pyridin-2-one
CID 18723546
2(1H)-Pyridinone, 6-methyl-3-(trifluoromethyl)-
CID 20767670
N-(1-cyclohexa-2,4-dien-1-ylideneethyl)-2,2,2-trifluoroacetamide
CID 54172936

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one?
The IUPAC name of 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one (CID 10103416) is 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one.
What is the SMILES notation for 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one?
The canonical SMILES for 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one is Cc1cc(C(F)F)[nH]c(=O)c1.
What is the InChIKey of 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one?
The InChIKey is XNGLBBQBRDGDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2NO/c1-4-2-5(7(8)9)10-6(11)3-4/h2-3,7H,1H3,(H,10,11).
What are the key properties of 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one?
6-(difluoromethyl)-4-methyl-1H-pyridin-2-one has a molecular weight of 159.13 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-4-methyl-1H-pyridin-2-one is sourced from PubChem (CID 10103416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).