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

C18H11F4N3O — CID 109246460

IUPAC5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1cncc(Nc2c(F)cccc2F)c1
InChIInChI=1S/C18H11F4N3O/c19-13-5-4-11(7-16(13)22)25-18(26)10-6-12(9-23-8-10)24-17-14(20)2-1-3-15(17)21/h1-9,24H,(H,25,26)
InChIKeyYJSTWDVSWBNUKQ-UHFFFAOYSA-N
MW361.30 g/mol
LogP4.63
Rot. Bonds4

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

5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide (PubChem CID 109246460) has the molecular formula C18H11F4N3O and a molecular weight of 361.30 g/mol. Its IUPAC name is 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide
PubChem CID109246460
Molecular FormulaC18H11F4N3O
Molecular Weight361.30 g/mol
Exact Mass361.08
IUPAC Name5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1cncc(Nc2c(F)cccc2F)c1
InChIInChI=1S/C18H11F4N3O/c19-13-5-4-11(7-16(13)22)25-18(26)10-6-12(9-23-8-10)24-17-14(20)2-1-3-15(17)21/h1-9,24H,(H,25,26)
InChIKeyYJSTWDVSWBNUKQ-UHFFFAOYSA-N
XLogP4.63
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.30
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-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

5-(2,6-difluoroanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109246109
N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide
CID 63864937
2-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyrimidine-5-carboxamide
CID 109270748
5-(2,6-difluoroanilino)pyridine-3-carboxylic acid
CID 82535068
N-tert-butyl-5-(2,6-difluoroanilino)pyridine-3-carboxamide
CID 109239372
5-(5-chloro-2-methylanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide
CID 109244782
5-(2,6-difluoroanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245567
3-N-(3,4-difluorophenyl)-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 109101520
N-(3-acetamidophenyl)-5-(4-chloroanilino)pyridine-3-carboxamide
CID 109244632
N-(3,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109242899
5-[2-(4-chlorophenyl)ethylamino]-N-(3,4-difluorophenyl)pyridine-3-carboxamide
CID 109237881
N-(3,4-difluorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231628

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide (CID 109246460) is 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide is O=C(Nc1ccc(F)c(F)c1)c1cncc(Nc2c(F)cccc2F)c1.
What is the InChIKey of 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide?
The InChIKey is YJSTWDVSWBNUKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11F4N3O/c19-13-5-4-11(7-16(13)22)25-18(26)10-6-12(9-23-8-10)24-17-14(20)2-1-3-15(17)21/h1-9,24H,(H,25,26).
What are the key properties of 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide?
5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide has a molecular weight of 361.30 g/mol, XLogP of 4.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109246460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).