5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide

C21H21N3O — CID 109197157

IUPAC5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
SMILESCc1ccc(C)c(Nc2ccc(C(=O)Nc3ccccc3C)nc2)c1
InChIInChI=1S/C21H21N3O/c1-14-8-9-16(3)20(12-14)23-17-10-11-19(22-13-17)21(25)24-18-7-5-4-6-15(18)2/h4-13,23H,1-3H3,(H,24,25)
InChIKeyJVJXVZMWMOLLBY-UHFFFAOYSA-N
MW331.42 g/mol
LogP5.00
Rot. Bonds4

About 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide

5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide (PubChem CID 109197157) has the molecular formula C21H21N3O and a molecular weight of 331.42 g/mol. Its IUPAC name is 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
PubChem CID109197157
Molecular FormulaC21H21N3O
Molecular Weight331.42 g/mol
Exact Mass331.17
IUPAC Name5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
SMILESCc1ccc(C)c(Nc2ccc(C(=O)Nc3ccccc3C)nc2)c1
InChIInChI=1S/C21H21N3O/c1-14-8-9-16(3)20(12-14)23-17-10-11-19(22-13-17)21(25)24-18-7-5-4-6-15(18)2/h4-13,23H,1-3H3,(H,24,25)
InChIKeyJVJXVZMWMOLLBY-UHFFFAOYSA-N
XLogP5.00
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.42
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,5-dimethylanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198055
ethyl 2-[[5-(2,5-dimethylanilino)pyridine-2-carbonyl]amino]benzoate
CID 109198079
N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109197955
5-anilino-N-(2,4-dimethylphenyl)pyridine-2-carboxamide
CID 109197061
5-(4-fluoroanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197166
N-(2,5-dimethylphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639933
N-cyclopropyl-5-(2,5-dimethylanilino)pyridine-2-carboxamide
CID 109179930
5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197177
N-(2,5-dimethylphenyl)-5-(3-fluoroanilino)pyridine-2-carboxamide
CID 109198040
5-(2,5-dimethylanilino)-N-[(4-methylphenyl)methyl]pyridine-2-carboxamide
CID 109188662
N-(2,5-dimethylphenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104639934
5-(2,5-dimethylanilino)-N-[2-(2-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109192183

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide (CID 109197157) is 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide is Cc1ccc(C)c(Nc2ccc(C(=O)Nc3ccccc3C)nc2)c1.
What is the InChIKey of 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide?
The InChIKey is JVJXVZMWMOLLBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O/c1-14-8-9-16(3)20(12-14)23-17-10-11-19(22-13-17)21(25)24-18-7-5-4-6-15(18)2/h4-13,23H,1-3H3,(H,24,25).
What are the key properties of 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide?
5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 5.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109197157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).