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

C20H17F2N3O — CID 109162562

IUPACN-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide
SMILESCc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)cn2)c(C)c1
InChIInChI=1S/C20H17F2N3O/c1-12-3-6-17(13(2)9-12)24-19-8-4-14(11-23-19)20(26)25-18-7-5-15(21)10-16(18)22/h3-11H,1-2H3,(H,23,24)(H,25,26)
InChIKeyCCAJMYOYBUNDHZ-UHFFFAOYSA-N
MW353.37 g/mol
LogP4.97
Rot. Bonds4

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

N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide (PubChem CID 109162562) has the molecular formula C20H17F2N3O and a molecular weight of 353.37 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide
PubChem CID109162562
Molecular FormulaC20H17F2N3O
Molecular Weight353.37 g/mol
Exact Mass353.13
IUPAC NameN-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide
SMILESCc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)cn2)c(C)c1
InChIInChI=1S/C20H17F2N3O/c1-12-3-6-17(13(2)9-12)24-19-8-4-14(11-23-19)20(26)25-18-7-5-15(21)10-16(18)22/h3-11H,1-2H3,(H,23,24)(H,25,26)
InChIKeyCCAJMYOYBUNDHZ-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

6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide
CID 109164503
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242767
6-(2,4-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109162546
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide
CID 109198012
ethyl 2-[[5-[(2,4-difluorophenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109164884
4-N-(2,4-difluorophenyl)-2-N-(2,4-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091777
5-[(2-fluoro-4-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43414745
N-[6-(2,4-dimethylanilino)-3-pyridinyl]-2-fluorobenzamide
CID 18419487
5-(2,4-difluoroanilino)-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 109242709
N-[6-(2,4-dimethylanilino)-3-pyridinyl]pyridine-3-carboxamide
CID 113016789
6-(2,4-difluoroanilino)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109164851
N-cyclohexyl-6-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 1441232

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide (CID 109162562) is N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide is Cc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)cn2)c(C)c1.
What is the InChIKey of N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide?
The InChIKey is CCAJMYOYBUNDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F2N3O/c1-12-3-6-17(13(2)9-12)24-19-8-4-14(11-23-19)20(26)25-18-7-5-15(21)10-16(18)22/h3-11H,1-2H3,(H,23,24)(H,25,26).
What are the key properties of N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide?
N-(2,4-difluorophenyl)-6-(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)-6-(2,4-dimethylanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109162562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).