4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide

C22H19N3O2 — CID 3285484

IUPAC4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide
SMILESCc1ccccc1C=NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C22H19N3O2/c1-16-7-5-6-10-19(16)15-23-25-22(27)18-11-13-20(14-12-18)24-21(26)17-8-3-2-4-9-17/h2-15H,1H3,(H,24,26)(H,25,27)
InChIKeySUGJHANRQDXAEL-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.01
Rot. Bonds5

About 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide

4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide (PubChem CID 3285484) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide
PubChem CID3285484
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC Name4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide
SMILESCc1ccccc1C=NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C22H19N3O2/c1-16-7-5-6-10-19(16)15-23-25-22(27)18-11-13-20(14-12-18)24-21(26)17-8-3-2-4-9-17/h2-15H,1H3,(H,24,26)(H,25,27)
InChIKeySUGJHANRQDXAEL-UHFFFAOYSA-N
XLogP4.01
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-benzamido-N-[(2-methylphenyl)methylideneamino]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-[(2-methylphenyl)methylideneamino]pyridine-4-carboxamide
CID 690992
3,4-dihydroxy-N-[(2-methylphenyl)methylideneamino]benzamide
CID 794492
N-[(2-methylphenyl)methylideneamino]-4-phenylmethoxybenzamide
CID 4932964
N-[(Z)-(2-methylphenyl)methylideneamino]-4-propoxybenzamide
CID 92659049
(4-benzamidophenyl)carbamic acid
CID 18543096
N-(benzylideneamino)-4-[(4-fluorobenzoyl)amino]benzamide
CID 24789540
4-benzamido-N-[(E)-1H-pyrrol-2-ylmethylideneamino]benzamide
CID 135696885
2-methyl-N-[4-[[(2,4,6-trimethylphenyl)methylideneamino]carbamoyl]phenyl]benzamide
CID 3376592
2-hydroxy-N-[(Z)-(2-methylphenyl)methylideneamino]benzamide
CID 5392167
4-acetamido-N-[(Z)-benzylideneamino]benzamide
CID 5397950
2-[(Z)-[(4-methylbenzoyl)hydrazinylidene]methyl]benzoic acid
CID 5418070
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-4-(2-methylpropanoylamino)benzamide
CID 137095702

Frequently Asked Questions

What is the IUPAC name of 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide?
The IUPAC name of 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide (CID 3285484) is 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide.
What is the SMILES notation for 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide?
The canonical SMILES for 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide is Cc1ccccc1C=NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide?
The InChIKey is SUGJHANRQDXAEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c1-16-7-5-6-10-19(16)15-23-25-22(27)18-11-13-20(14-12-18)24-21(26)17-8-3-2-4-9-17/h2-15H,1H3,(H,24,26)(H,25,27).
What are the key properties of 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide?
4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide has a molecular weight of 357.41 g/mol, XLogP of 4.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzamido-N-[(2-methylphenyl)methylideneamino]benzamide is sourced from PubChem (CID 3285484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).