N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide

C13H10F3N3O — CID 105385160

IUPACN-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
SMILESCNc1nccc(C(=O)Nc2cccc(F)c2F)c1F
InChIInChI=1S/C13H10F3N3O/c1-17-12-10(15)7(5-6-18-12)13(20)19-9-4-2-3-8(14)11(9)16/h2-6H,1H3,(H,17,18)(H,19,20)
InChIKeyPATDZCRWECNOBV-UHFFFAOYSA-N
MW281.24 g/mol
LogP2.79
Rot. Bonds3

About N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide

N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide (PubChem CID 105385160) has the molecular formula C13H10F3N3O and a molecular weight of 281.24 g/mol. Its IUPAC name is N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
PubChem CID105385160
Molecular FormulaC13H10F3N3O
Molecular Weight281.24 g/mol
Exact Mass281.08
IUPAC NameN-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
SMILESCNc1nccc(C(=O)Nc2cccc(F)c2F)c1F
InChIInChI=1S/C13H10F3N3O/c1-17-12-10(15)7(5-6-18-12)13(20)19-9-4-2-3-8(14)11(9)16/h2-6H,1H3,(H,17,18)(H,19,20)
InChIKeyPATDZCRWECNOBV-UHFFFAOYSA-N
XLogP2.79
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.24
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-2-(methylamino)-N-(2,3,5-trifluorophenyl)pyridine-4-carboxamide
CID 105386062
3-fluoro-N-(2-fluoro-4-methylphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 105383951
5-bromo-N-(2,3-difluorophenyl)-2-(methylamino)pyridine-3-carboxamide
CID 62181848
N-(5-chloro-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105383965
3-fluoro-N-(5-fluoro-2-methylphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 105384530
N-(4-bromo-5-fluoro-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105387648
N-(5-bromo-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105385053
N-(2-bromo-4-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105384019
N-(2-chloro-5-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 107631178
N-(5-chloro-2-cyanophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105386639
3-fluoro-2-(methylamino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
CID 105384003
N-(5-cyano-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105385118

Frequently Asked Questions

What is the IUPAC name of N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide (CID 105385160) is N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide is CNc1nccc(C(=O)Nc2cccc(F)c2F)c1F.
What is the InChIKey of N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide?
The InChIKey is PATDZCRWECNOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3N3O/c1-17-12-10(15)7(5-6-18-12)13(20)19-9-4-2-3-8(14)11(9)16/h2-6H,1H3,(H,17,18)(H,19,20).
What are the key properties of N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide?
N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide has a molecular weight of 281.24 g/mol, XLogP of 2.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-difluorophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105385160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).