2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide

C12H9F2N3O — CID 105380291

IUPAC2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide
SMILESCc1ccc(NC(=O)c2ccnc(F)c2F)nc1
InChIInChI=1S/C12H9F2N3O/c1-7-2-3-9(16-6-7)17-12(18)8-4-5-15-11(14)10(8)13/h2-6H,1H3,(H,16,17,18)
InChIKeyUFNFJJZVJBRILD-UHFFFAOYSA-N
MW249.22 g/mol
LogP2.32
Rot. Bonds2

About 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide

2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide (PubChem CID 105380291) has the molecular formula C12H9F2N3O and a molecular weight of 249.22 g/mol. Its IUPAC name is 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide
PubChem CID105380291
Molecular FormulaC12H9F2N3O
Molecular Weight249.22 g/mol
Exact Mass249.07
IUPAC Name2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide
SMILESCc1ccc(NC(=O)c2ccnc(F)c2F)nc1
InChIInChI=1S/C12H9F2N3O/c1-7-2-3-9(16-6-7)17-12(18)8-4-5-15-11(14)10(8)13/h2-6H,1H3,(H,16,17,18)
InChIKeyUFNFJJZVJBRILD-UHFFFAOYSA-N
XLogP2.32
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.22
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3-difluoro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 105380183
2,3-difluoro-N-(5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 107470488
N-(4-chlorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380159
4-chloro-2-fluoro-N-(5-methyl-2-pyridinyl)benzamide
CID 26028133
3-(methylamino)-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide
CID 105068062
2,5-dimethyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide
CID 18106811
2-amino-4-fluoro-N-(5-methyl-2-pyridinyl)benzamide
CID 112687750
N-(2,5-difluoro-4-methylphenyl)-2,3-difluoropyridine-4-carboxamide
CID 103585463
N-(2,6-difluorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380320
2,3-difluoro-N-(thiadiazol-5-yl)pyridine-4-carboxamide
CID 105381676
[4,5-difluoro-2-[(5-methyl-2-pyridinyl)carbamoyl]phenyl]-hydroxyazanium
CID 142112043
2,3-difluoro-N-(4-hydroxy-2-methylphenyl)pyridine-4-carboxamide
CID 105381289

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide?
The IUPAC name of 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide (CID 105380291) is 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide.
What is the SMILES notation for 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide?
The canonical SMILES for 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide is Cc1ccc(NC(=O)c2ccnc(F)c2F)nc1.
What is the InChIKey of 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide?
The InChIKey is UFNFJJZVJBRILD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2N3O/c1-7-2-3-9(16-6-7)17-12(18)8-4-5-15-11(14)10(8)13/h2-6H,1H3,(H,16,17,18).
What are the key properties of 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide?
2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide has a molecular weight of 249.22 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-(5-methyl-2-pyridinyl)pyridine-4-carboxamide is sourced from PubChem (CID 105380291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).