N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

C20H19N3O — CID 110360894

IUPACN-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESCc1cc(C)cc(N(Cc2cccnc2)C(=O)c2cccnc2)c1
InChIInChI=1S/C20H19N3O/c1-15-9-16(2)11-19(10-15)23(14-17-5-3-7-21-12-17)20(24)18-6-4-8-22-13-18/h3-13H,14H2,1-2H3
InChIKeyAMPTXAHGDWFJOD-UHFFFAOYSA-N
MW317.39 g/mol
LogP3.94
Rot. Bonds4

About N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 110360894) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID110360894
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC NameN-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESCc1cc(C)cc(N(Cc2cccnc2)C(=O)c2cccnc2)c1
InChIInChI=1S/C20H19N3O/c1-15-9-16(2)11-19(10-15)23(14-17-5-3-7-21-12-17)20(24)18-6-4-8-22-13-18/h3-13H,14H2,1-2H3
InChIKeyAMPTXAHGDWFJOD-UHFFFAOYSA-N
XLogP3.94
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-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-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 110360828
N-benzyl-N-phenylpyridine-3-carboxamide;hydrochloride
CID 110756627
3,5-dimethoxy-N-(3-methylphenyl)-N-(pyridin-3-ylmethyl)benzamide
CID 110360333
1,1-dimethyl-3-(3-methylphenyl)-3-(pyridin-3-ylmethyl)urea
CID 110360355
N-(4-fluorophenyl)-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 110360811
3-methylsulfonyl-N-phenyl-N-(pyridin-3-ylmethyl)benzamide
CID 110619955
ethyl 4-[(3-ethoxybenzoyl)-(pyridin-3-ylmethyl)amino]benzoate
CID 19631305
1-(3,4-dimethylphenyl)-3,3-diethyl-1-(pyridin-3-ylmethyl)urea
CID 110360929
3-chloro-N-(3-methoxyphenyl)-N-(pyridin-3-ylmethyl)benzamide
CID 110360522
N-(4-methylphenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 110360399
3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 40508102
N-(4-fluoro-1,3-benzothiazol-2-yl)-3,5-dimethyl-N-(pyridin-3-ylmethyl)benzamide
CID 43966923

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide (CID 110360894) is N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide is Cc1cc(C)cc(N(Cc2cccnc2)C(=O)c2cccnc2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is AMPTXAHGDWFJOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c1-15-9-16(2)11-19(10-15)23(14-17-5-3-7-21-12-17)20(24)18-6-4-8-22-13-18/h3-13H,14H2,1-2H3.
What are the key properties of N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 3.94, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 110360894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).