2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide

C13H10F2N2O2 — CID 47067429

IUPAC2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide
SMILESCn1cc(NC(=O)c2ccc(F)cc2F)ccc1=O
InChIInChI=1S/C13H10F2N2O2/c1-17-7-9(3-5-12(17)18)16-13(19)10-4-2-8(14)6-11(10)15/h2-7H,1H3,(H,16,19)
InChIKeyYJMUSMZATCLEAL-UHFFFAOYSA-N
MW264.23 g/mol
LogP1.92
Rot. Bonds2

About 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide

2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide (PubChem CID 47067429) has the molecular formula C13H10F2N2O2 and a molecular weight of 264.23 g/mol. Its IUPAC name is 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide.

Molecular Properties

Compound Name2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide
PubChem CID47067429
Molecular FormulaC13H10F2N2O2
Molecular Weight264.23 g/mol
Exact Mass264.07
IUPAC Name2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide
SMILESCn1cc(NC(=O)c2ccc(F)cc2F)ccc1=O
InChIInChI=1S/C13H10F2N2O2/c1-17-7-9(3-5-12(17)18)16-13(19)10-4-2-8(14)6-11(10)15/h2-7H,1H3,(H,16,19)
InChIKeyYJMUSMZATCLEAL-UHFFFAOYSA-N
XLogP1.92
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.23
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide?
The IUPAC name of 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide (CID 47067429) is 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide.
What is the SMILES notation for 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide?
The canonical SMILES for 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide is Cn1cc(NC(=O)c2ccc(F)cc2F)ccc1=O.
What is the InChIKey of 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide?
The InChIKey is YJMUSMZATCLEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N2O2/c1-17-7-9(3-5-12(17)18)16-13(19)10-4-2-8(14)6-11(10)15/h2-7H,1H3,(H,16,19).
What are the key properties of 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide?
2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide has a molecular weight of 264.23 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-(1-methyl-6-oxo-3-pyridinyl)benzamide is sourced from PubChem (CID 47067429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).