2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide

C21H19N3O2 — CID 109091261

IUPAC2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide
SMILESCc1ccc(NC(=O)c2ccnc(C(=O)N(C)c3ccccc3)c2)cc1
InChIInChI=1S/C21H19N3O2/c1-15-8-10-17(11-9-15)23-20(25)16-12-13-22-19(14-16)21(26)24(2)18-6-4-3-5-7-18/h3-14H,1-2H3,(H,23,25)
InChIKeyFDFDBKALBOTEKW-UHFFFAOYSA-N
MW345.40 g/mol
LogP3.92
Rot. Bonds4

About 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide

2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide (PubChem CID 109091261) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide
PubChem CID109091261
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide
SMILESCc1ccc(NC(=O)c2ccnc(C(=O)N(C)c3ccccc3)c2)cc1
InChIInChI=1S/C21H19N3O2/c1-15-8-10-17(11-9-15)23-20(25)16-12-13-22-19(14-16)21(26)24(2)18-6-4-3-5-7-18/h3-14H,1-2H3,(H,23,25)
InChIKeyFDFDBKALBOTEKW-UHFFFAOYSA-N
XLogP3.92
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(4-chlorophenyl)-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
CID 109091489
4-N-(4-methoxyphenyl)-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
CID 109091500
4-N-(3-chloro-4-fluorophenyl)-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
CID 109091494
methyl 3-[[2-[methyl(phenyl)carbamoyl]pyridine-4-carbonyl]amino]benzoate
CID 109091517
2-N-methyl-2-N-phenyl-4-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109091478
2-N-methyl-2-N-phenyl-4-N-propylpyridine-2,4-dicarboxamide
CID 109077708
4-[methyl-(4-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 115730175
4-N-benzyl-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
CID 109085321
N-[4-[methyl(phenyl)carbamoyl]phenyl]pyridine-4-carboxamide
CID 17230224
3-N-methyl-1-N,3-N-diphenylbenzene-1,3-dicarboxamide
CID 109056757
4-N-(4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091349
4-N-(3,4-dimethylphenyl)-2-N-ethyl-2-N-phenylpyridine-2,4-dicarboxamide
CID 109091876

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide (CID 109091261) is 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide is Cc1ccc(NC(=O)c2ccnc(C(=O)N(C)c3ccccc3)c2)cc1.
What is the InChIKey of 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide?
The InChIKey is FDFDBKALBOTEKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-15-8-10-17(11-9-15)23-20(25)16-12-13-22-19(14-16)21(26)24(2)18-6-4-3-5-7-18/h3-14H,1-2H3,(H,23,25).
What are the key properties of 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide?
2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide has a molecular weight of 345.40 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-4-N-(4-methylphenyl)-2-N-phenylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109091261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).