4-benzamido-N-(cinnamylideneamino)benzamide

C23H19N3O2 — CID 5097860

IUPAC4-benzamido-N-(cinnamylideneamino)benzamide
SMILESO=C(NN=CC=Cc1ccccc1)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C23H19N3O2/c27-22(19-11-5-2-6-12-19)25-21-15-13-20(14-16-21)23(28)26-24-17-7-10-18-8-3-1-4-9-18/h1-17H,(H,25,27)(H,26,28)
InChIKeyFISHLWUXXFJTKV-UHFFFAOYSA-N
MW369.42 g/mol
LogP4.37
Rot. Bonds6

About 4-benzamido-N-(cinnamylideneamino)benzamide

4-benzamido-N-(cinnamylideneamino)benzamide (PubChem CID 5097860) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is 4-benzamido-N-(cinnamylideneamino)benzamide.

Molecular Properties

Compound Name4-benzamido-N-(cinnamylideneamino)benzamide
PubChem CID5097860
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC Name4-benzamido-N-(cinnamylideneamino)benzamide
SMILESO=C(NN=CC=Cc1ccccc1)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C23H19N3O2/c27-22(19-11-5-2-6-12-19)25-21-15-13-20(14-16-21)23(28)26-24-17-7-10-18-8-3-1-4-9-18/h1-17H,(H,25,27)(H,26,28)
InChIKeyFISHLWUXXFJTKV-UHFFFAOYSA-N
XLogP4.37
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 54.37
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-(cinnamylideneamino)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

4-(cyclopropanecarbonylamino)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]benzamide
CID 17234587
4-(3-methylbutanoylamino)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]benzamide
CID 17234592
4-(cyclohexanecarbonylamino)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]benzamide
CID 17234588
4-nitro-N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]benzamide
CID 92529886
2-[(4-methylbenzoyl)amino]-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]benzamide
CID 126007946
1,3-bis(cinnamylideneamino)urea
CID 2823909
N-(benzylideneamino)-4-[(4-fluorobenzoyl)amino]benzamide
CID 24789540
N-(cinnamylideneamino)-3,4-dimethoxybenzamide
CID 6824789
N-(cinnamylideneamino)-3-[3-(hydroxyamino)-3-oxoprop-1-enyl]benzamide
CID 123609140
[(E)-[(Z)-3-phenylprop-2-enylidene]amino]urea
CID 92529945
N-(cinnamylideneamino)-2-iodobenzamide
CID 4982683
4-acetamido-N-[(Z)-benzylideneamino]benzamide
CID 5397950

Frequently Asked Questions

What is the IUPAC name of 4-benzamido-N-(cinnamylideneamino)benzamide?
The IUPAC name of 4-benzamido-N-(cinnamylideneamino)benzamide (CID 5097860) is 4-benzamido-N-(cinnamylideneamino)benzamide.
What is the SMILES notation for 4-benzamido-N-(cinnamylideneamino)benzamide?
The canonical SMILES for 4-benzamido-N-(cinnamylideneamino)benzamide is O=C(NN=CC=Cc1ccccc1)c1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of 4-benzamido-N-(cinnamylideneamino)benzamide?
The InChIKey is FISHLWUXXFJTKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c27-22(19-11-5-2-6-12-19)25-21-15-13-20(14-16-21)23(28)26-24-17-7-10-18-8-3-1-4-9-18/h1-17H,(H,25,27)(H,26,28).
What are the key properties of 4-benzamido-N-(cinnamylideneamino)benzamide?
4-benzamido-N-(cinnamylideneamino)benzamide has a molecular weight of 369.42 g/mol, XLogP of 4.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzamido-N-(cinnamylideneamino)benzamide is sourced from PubChem (CID 5097860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).