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

C20H17F2N3O — CID 109242767

IUPACN-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
SMILESCc1ccc(Nc2cncc(C(=O)Nc3ccc(F)cc3F)c2)c(C)c1
InChIInChI=1S/C20H17F2N3O/c1-12-3-5-18(13(2)7-12)24-16-8-14(10-23-11-16)20(26)25-19-6-4-15(21)9-17(19)22/h3-11,24H,1-2H3,(H,25,26)
InChIKeyDLNFKKLZRQXACE-UHFFFAOYSA-N
MW353.37 g/mol
LogP4.97
Rot. Bonds4

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

N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide (PubChem CID 109242767) 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-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
PubChem CID109242767
Molecular FormulaC20H17F2N3O
Molecular Weight353.37 g/mol
Exact Mass353.13
IUPAC NameN-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
SMILESCc1ccc(Nc2cncc(C(=O)Nc3ccc(F)cc3F)c2)c(C)c1
InChIInChI=1S/C20H17F2N3O/c1-12-3-5-18(13(2)7-12)24-16-8-14(10-23-11-16)20(26)25-19-6-4-15(21)9-17(19)22/h3-11,24H,1-2H3,(H,25,26)
InChIKeyDLNFKKLZRQXACE-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

5-(2,4-difluoroanilino)-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 109242709
N-(2,4-dimethylphenyl)-5-(4-fluoroanilino)pyridine-3-carboxamide
CID 109242670
N-(2,4-dimethylphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide
CID 109242702
N-(2,4-difluorophenyl)-5-(2,3,4-trifluoroanilino)pyridine-3-carboxamide
CID 109246256
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide
CID 109198012
N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109162562
5-(3-chloro-4-fluoroanilino)-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 109242674
N-(4-acetylphenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242751
N-(4-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-3-carboxamide
CID 109244598
N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide
CID 109245433
N-(4-chloro-2-methylphenyl)-5-(4-fluoroanilino)pyridine-3-carboxamide
CID 109244302
5-(2,4-dimethylanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109242737

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide (CID 109242767) is N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide is Cc1ccc(Nc2cncc(C(=O)Nc3ccc(F)cc3F)c2)c(C)c1.
What is the InChIKey of N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide?
The InChIKey is DLNFKKLZRQXACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F2N3O/c1-12-3-5-18(13(2)7-12)24-16-8-14(10-23-11-16)20(26)25-19-6-4-15(21)9-17(19)22/h3-11,24H,1-2H3,(H,25,26).
What are the key properties of N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide?
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-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-3-carboxamide is sourced from PubChem (CID 109242767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).