4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide

C18H13F2N3O — CID 16730836

IUPAC4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc(-c3cc(F)cc(F)c3)ccn2)n1
InChIInChI=1S/C18H13F2N3O/c1-11-3-2-4-17(22-11)23-18(24)16-9-12(5-6-21-16)13-7-14(19)10-15(20)8-13/h2-10H,1H3,(H,22,23,24)
InChIKeyCVBWBHLJBLFSFF-UHFFFAOYSA-N
MW325.32 g/mol
LogP3.98
Rot. Bonds3

About 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide

4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide (PubChem CID 16730836) has the molecular formula C18H13F2N3O and a molecular weight of 325.32 g/mol. Its IUPAC name is 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide
PubChem CID16730836
Molecular FormulaC18H13F2N3O
Molecular Weight325.32 g/mol
Exact Mass325.10
IUPAC Name4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc(-c3cc(F)cc(F)c3)ccn2)n1
InChIInChI=1S/C18H13F2N3O/c1-11-3-2-4-17(22-11)23-18(24)16-9-12(5-6-21-16)13-7-14(19)10-15(20)8-13/h2-10H,1H3,(H,22,23,24)
InChIKeyCVBWBHLJBLFSFF-UHFFFAOYSA-N
XLogP3.98
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.32
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide (CID 16730836) is 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide is Cc1cccc(NC(=O)c2cc(-c3cc(F)cc(F)c3)ccn2)n1.
What is the InChIKey of 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide?
The InChIKey is CVBWBHLJBLFSFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F2N3O/c1-11-3-2-4-17(22-11)23-18(24)16-9-12(5-6-21-16)13-7-14(19)10-15(20)8-13/h2-10H,1H3,(H,22,23,24).
What are the key properties of 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide?
4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide has a molecular weight of 325.32 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-difluorophenyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 16730836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).