5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide

C20H19N3O — CID 109232664

IUPAC5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide
SMILESCc1ccc(CNc2cncc(C(=O)Nc3ccccc3)c2)cc1
InChIInChI=1S/C20H19N3O/c1-15-7-9-16(10-8-15)12-22-19-11-17(13-21-14-19)20(24)23-18-5-3-2-4-6-18/h2-11,13-14,22H,12H2,1H3,(H,23,24)
InChIKeyJPCZWMORDVIKPR-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.25
Rot. Bonds5

About 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide

5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide (PubChem CID 109232664) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide
PubChem CID109232664
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC Name5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide
SMILESCc1ccc(CNc2cncc(C(=O)Nc3ccccc3)c2)cc1
InChIInChI=1S/C20H19N3O/c1-15-7-9-16(10-8-15)12-22-19-11-17(13-21-14-19)20(24)23-18-5-3-2-4-6-18/h2-11,13-14,22H,12H2,1H3,(H,23,24)
InChIKeyJPCZWMORDVIKPR-UHFFFAOYSA-N
XLogP4.25
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-methylphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232401
N-[4-(diethylamino)phenyl]-5-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232722
N-(2-cyanophenyl)-5-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232741
N-(2,4-dimethylphenyl)-5-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232671
5-(benzylamino)-N-(4-bromophenyl)pyridine-3-carboxamide
CID 109231882
5-[(2-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide
CID 109232130
5-(benzylamino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109231885
5-(benzylamino)-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
CID 109231930
5-[(4-methylphenyl)methylamino]-N-propylpyridine-3-carboxamide
CID 109222786
N-[(4-methylphenyl)methyl]-5-(pyridin-4-ylmethylamino)pyridine-3-carboxamide
CID 109232496
N-[(3-methylphenyl)methyl]-5-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232216
N-(2,4-dichlorophenyl)-5-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232734

Frequently Asked Questions

What is the IUPAC name of 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide?
The IUPAC name of 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide (CID 109232664) is 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide?
The canonical SMILES for 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide is Cc1ccc(CNc2cncc(C(=O)Nc3ccccc3)c2)cc1.
What is the InChIKey of 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide?
The InChIKey is JPCZWMORDVIKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c1-15-7-9-16(10-8-15)12-22-19-11-17(13-21-14-19)20(24)23-18-5-3-2-4-6-18/h2-11,13-14,22H,12H2,1H3,(H,23,24).
What are the key properties of 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide?
5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 4.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 109232664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).