3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide

C23H21N3O4 — CID 178016044

IUPAC3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide
SMILESO=C(NO)c1cccc(NC(=O)C(Cc2ccccc2)NC(=O)c2ccccc2)c1
InChIInChI=1S/C23H21N3O4/c27-21(17-10-5-2-6-11-17)25-20(14-16-8-3-1-4-9-16)23(29)24-19-13-7-12-18(15-19)22(28)26-30/h1-13,15,20,30H,14H2,(H,24,29)(H,25,27)(H,26,28)
InChIKeyQNKMBEBFRZXQIG-UHFFFAOYSA-N
MW403.44 g/mol
LogP2.79
Rot. Bonds7

About 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide

3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide (PubChem CID 178016044) has the molecular formula C23H21N3O4 and a molecular weight of 403.44 g/mol. Its IUPAC name is 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide.

Molecular Properties

Compound Name3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide
PubChem CID178016044
Molecular FormulaC23H21N3O4
Molecular Weight403.44 g/mol
Exact Mass403.15
IUPAC Name3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide
SMILESO=C(NO)c1cccc(NC(=O)C(Cc2ccccc2)NC(=O)c2ccccc2)c1
InChIInChI=1S/C23H21N3O4/c27-21(17-10-5-2-6-11-17)25-20(14-16-8-3-1-4-9-16)23(29)24-19-13-7-12-18(15-19)22(28)26-30/h1-13,15,20,30H,14H2,(H,24,29)(H,25,27)(H,26,28)
InChIKeyQNKMBEBFRZXQIG-UHFFFAOYSA-N
XLogP2.79
TPSA107.53 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.44
LogP ≤ 52.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide 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-[[2-benzamido-3-(4-phenylphenyl)propanoyl]amino]-N-hydroxybenzamide
CID 73041441
N-[1-(3-acetamidoanilino)-1-oxo-3-phenylpropan-2-yl]-4-chlorobenzamide
CID 55335522
3-[(2-acetamido-3-naphthalen-2-ylpropanoyl)amino]-N-hydroxybenzamide
CID 87454003
4-chloro-N-[1-[3-(cyclopropanecarbonylamino)anilino]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 55573094
N-[1-(2-benzylanilino)-1-oxo-3-phenylpropan-2-yl]-3-bromobenzamide
CID 4990800
2-benzamido-N-[(2S)-1-(3-methylanilino)-1-oxo-3-phenylpropan-2-yl]benzamide
CID 1340046
N-[1-[4-chloro-3-(trifluoromethyl)anilino]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 42904742
benzyl N-[(2S)-1-(3-acetylanilino)-1-oxo-3-phenylpropan-2-yl]carbamate
CID 7613158
N-[(2R)-1-(4-ethoxyanilino)-1-oxo-3-phenylpropan-2-yl]benzamide
CID 40631438
N-[1-(2-benzylanilino)-1-oxo-3-phenylpropan-2-yl]benzamide
CID 3872811
N-[1-(benzylamino)-1-oxo-3-phenylpropan-2-yl]benzamide
CID 17475548
N-hydroxy-3-[(4-phenylbenzoyl)amino]benzamide
CID 142750431

Frequently Asked Questions

What is the IUPAC name of 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide?
The IUPAC name of 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide (CID 178016044) is 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide.
What is the SMILES notation for 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide?
The canonical SMILES for 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide is O=C(NO)c1cccc(NC(=O)C(Cc2ccccc2)NC(=O)c2ccccc2)c1.
What is the InChIKey of 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide?
The InChIKey is QNKMBEBFRZXQIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O4/c27-21(17-10-5-2-6-11-17)25-20(14-16-8-3-1-4-9-16)23(29)24-19-13-7-12-18(15-19)22(28)26-30/h1-13,15,20,30H,14H2,(H,24,29)(H,25,27)(H,26,28).
What are the key properties of 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide?
3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide has a molecular weight of 403.44 g/mol, XLogP of 2.79, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-benzamido-3-phenylpropanoyl)amino]-N-hydroxybenzamide is sourced from PubChem (CID 178016044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).