N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide

C20H17F2N3O — CID 109198012

IUPACN-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide
SMILESCc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)nc2)c(C)c1
InChIInChI=1S/C20H17F2N3O/c1-12-3-6-17(13(2)9-12)24-15-5-8-19(23-11-15)20(26)25-18-7-4-14(21)10-16(18)22/h3-11,24H,1-2H3,(H,25,26)
InChIKeyHHQHVVKNMQMSMF-UHFFFAOYSA-N
MW353.37 g/mol
LogP4.97
Rot. Bonds4

About N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide

N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide (PubChem CID 109198012) has the molecular formula C20H17F2N3O and a molecular weight of 353.37 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide
PubChem CID109198012
Molecular FormulaC20H17F2N3O
Molecular Weight353.37 g/mol
Exact Mass353.13
IUPAC NameN-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide
SMILESCc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)nc2)c(C)c1
InChIInChI=1S/C20H17F2N3O/c1-12-3-6-17(13(2)9-12)24-15-5-8-19(23-11-15)20(26)25-18-7-4-14(21)10-16(18)22/h3-11,24H,1-2H3,(H,25,26)
InChIKeyHHQHVVKNMQMSMF-UHFFFAOYSA-N
XLogP4.97
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.37
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109197955
5-(2,4-difluoroanilino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109198177
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242767
N-(2-fluoro-4-methylphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639628
5-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198992
5-anilino-N-(2,4-difluorophenyl)pyridine-2-carboxamide
CID 109197129
5-(2,5-dimethylanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198055
5-anilino-N-(2,4-dimethylphenyl)pyridine-2-carboxamide
CID 109197061
N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109162562
4-N-(2,4-difluorophenyl)-2-N-(2,4-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091777
N-cyclopropyl-5-(2,4-dimethylanilino)pyridine-2-carboxamide
CID 109179929
5-(2,4-difluoroanilino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109199705

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide (CID 109198012) is N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide is Cc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)nc2)c(C)c1.
What is the InChIKey of N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide?
The InChIKey is HHQHVVKNMQMSMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F2N3O/c1-12-3-6-17(13(2)9-12)24-15-5-8-19(23-11-15)20(26)25-18-7-4-14(21)10-16(18)22/h3-11,24H,1-2H3,(H,25,26).
What are the key properties of N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide?
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide has a molecular weight of 353.37 g/mol, XLogP of 4.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109198012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).