5-(difluoromethylidene)-6-methylpyridin-2-one

C7H5F2NO — CID 156595535

IUPAC5-(difluoromethylidene)-6-methylpyridin-2-one
SMILESCC1=NC(=O)C=CC1=C(F)F
InChIInChI=1S/C7H5F2NO/c1-4-5(7(8)9)2-3-6(11)10-4/h2-3H,1H3
InChIKeyYJKBMQLGYRMKTL-UHFFFAOYSA-N
MW157.12 g/mol
LogP1.69
Rot. Bonds

About 5-(difluoromethylidene)-6-methylpyridin-2-one

5-(difluoromethylidene)-6-methylpyridin-2-one (PubChem CID 156595535) has the molecular formula C7H5F2NO and a molecular weight of 157.12 g/mol. Its IUPAC name is 5-(difluoromethylidene)-6-methylpyridin-2-one.

Molecular Properties

Compound Name5-(difluoromethylidene)-6-methylpyridin-2-one
PubChem CID156595535
Molecular FormulaC7H5F2NO
Molecular Weight157.12 g/mol
Exact Mass157.03
IUPAC Name5-(difluoromethylidene)-6-methylpyridin-2-one
SMILESCC1=NC(=O)C=CC1=C(F)F
InChIInChI=1S/C7H5F2NO/c1-4-5(7(8)9)2-3-6(11)10-4/h2-3H,1H3
InChIKeyYJKBMQLGYRMKTL-UHFFFAOYSA-N
XLogP1.69
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.12
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethylidene)-6-methylpyridin-2-one?
The IUPAC name of 5-(difluoromethylidene)-6-methylpyridin-2-one (CID 156595535) is 5-(difluoromethylidene)-6-methylpyridin-2-one.
What is the SMILES notation for 5-(difluoromethylidene)-6-methylpyridin-2-one?
The canonical SMILES for 5-(difluoromethylidene)-6-methylpyridin-2-one is CC1=NC(=O)C=CC1=C(F)F.
What is the InChIKey of 5-(difluoromethylidene)-6-methylpyridin-2-one?
The InChIKey is YJKBMQLGYRMKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F2NO/c1-4-5(7(8)9)2-3-6(11)10-4/h2-3H,1H3.
What are the key properties of 5-(difluoromethylidene)-6-methylpyridin-2-one?
5-(difluoromethylidene)-6-methylpyridin-2-one has a molecular weight of 157.12 g/mol, XLogP of 1.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethylidene)-6-methylpyridin-2-one is sourced from PubChem (CID 156595535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).