2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide

C24H25N3O2 — CID 109091918

IUPAC2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(C(C)C)cc3)ccn2)cc1C
InChIInChI=1S/C24H25N3O2/c1-15(2)18-6-9-20(10-7-18)26-23(28)19-11-12-25-22(14-19)24(29)27-21-8-5-16(3)17(4)13-21/h5-15H,1-4H3,(H,26,28)(H,27,29)
InChIKeyXPAHOXDAUXVCIK-UHFFFAOYSA-N
MW387.48 g/mol
LogP5.33
Rot. Bonds5

About 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide

2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109091918) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109091918
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(C(C)C)cc3)ccn2)cc1C
InChIInChI=1S/C24H25N3O2/c1-15(2)18-6-9-20(10-7-18)26-23(28)19-11-12-25-22(14-19)24(29)27-21-8-5-16(3)17(4)13-21/h5-15H,1-4H3,(H,26,28)(H,27,29)
InChIKeyXPAHOXDAUXVCIK-UHFFFAOYSA-N
XLogP5.33
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 55.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(4-chlorophenyl)-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092487
4-[(4-propan-2-ylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 115730066
2-N-(3-chlorophenyl)-4-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091882
4-N-(5-methyl-1,2-oxazol-3-yl)-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092499
4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109080780
2-N-(2-chlorophenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092468
4-N-(3,4-dimethylphenyl)-2-N-(3-methylbutyl)pyridine-2,4-dicarboxamide
CID 109089662
4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091921
2-N-(3-chloro-4-methylphenyl)-4-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091288
4-N-(3,4-dimethylphenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109091879
N-(3,4-dimethylphenyl)-4-methylpyridine-2-carboxamide
CID 110857354
4-N-(3-chloro-4-methylphenyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092947

Frequently Asked Questions

What is the IUPAC name of 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide (CID 109091918) is 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide is Cc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(C(C)C)cc3)ccn2)cc1C.
What is the InChIKey of 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is XPAHOXDAUXVCIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-15(2)18-6-9-20(10-7-18)26-23(28)19-11-12-25-22(14-19)24(29)27-21-8-5-16(3)17(4)13-21/h5-15H,1-4H3,(H,26,28)(H,27,29).
What are the key properties of 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 387.48 g/mol, XLogP of 5.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109091918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).