4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide

C20H19N3O — CID 113031308

IUPAC4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(Nc3ccccc3C)cn2)cc1
InChIInChI=1S/C20H19N3O/c1-14-7-9-16(10-8-14)20(24)23-19-12-11-17(13-21-19)22-18-6-4-3-5-15(18)2/h3-13,22H,1-2H3,(H,21,23,24)
InChIKeyHIFGESFUGJYSFQ-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.69
Rot. Bonds4

About 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide

4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide (PubChem CID 113031308) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide
PubChem CID113031308
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC Name4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(Nc3ccccc3C)cn2)cc1
InChIInChI=1S/C20H19N3O/c1-14-7-9-16(10-8-14)20(24)23-19-12-11-17(13-21-19)22-18-6-4-3-5-15(18)2/h3-13,22H,1-2H3,(H,21,23,24)
InChIKeyHIFGESFUGJYSFQ-UHFFFAOYSA-N
XLogP4.69
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide 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-[5-(2,4-dimethylanilino)-2-pyridinyl]benzamide
CID 113031952
methyl N-[5-(2-methylanilino)-2-pyridinyl]carbamate
CID 113031352
2-methyl-N-[5-(4-methylanilino)-2-pyridinyl]benzamide
CID 113031534
N-[5-(2,5-dimethylanilino)-2-pyridinyl]-4-methoxybenzamide
CID 113032033
N-[5-(2,6-difluoroanilino)-2-pyridinyl]-4-methylbenzamide
CID 113037492
N-[5-(2-methylanilino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113031347
N-[5-(3-fluoroanilino)-2-pyridinyl]-4-methylbenzamide
CID 113035866
4-methyl-N-[6-(4-methylanilino)-3-pyridinyl]benzamide
CID 113016330
N-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-4-methylbenzamide
CID 113034689
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]-4-methylbenzamide
CID 113034626
4-methyl-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011554
4-bromo-N-[5-(2-fluoroanilino)-2-pyridinyl]benzamide
CID 113032990

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide?
The IUPAC name of 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide (CID 113031308) is 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide.
What is the SMILES notation for 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide?
The canonical SMILES for 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide is Cc1ccc(C(=O)Nc2ccc(Nc3ccccc3C)cn2)cc1.
What is the InChIKey of 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide?
The InChIKey is HIFGESFUGJYSFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c1-14-7-9-16(10-8-14)20(24)23-19-12-11-17(13-21-19)22-18-6-4-3-5-15(18)2/h3-13,22H,1-2H3,(H,21,23,24).
What are the key properties of 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide?
4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide has a molecular weight of 317.39 g/mol, XLogP of 4.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide is sourced from PubChem (CID 113031308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).