4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide

C15H13ClN2O2 — CID 135445577

IUPAC4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
SMILESC/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccccc1O
InChIInChI=1S/C15H13ClN2O2/c1-10(13-4-2-3-5-14(13)19)17-18-15(20)11-6-8-12(16)9-7-11/h2-9,19H,1H3,(H,18,20)/b17-10+
InChIKeyUVCZJHCHDQMFGS-LICLKQGHSA-N
MW288.73 g/mol
LogP3.20
Rot. Bonds3

About 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide

4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide (PubChem CID 135445577) has the molecular formula C15H13ClN2O2 and a molecular weight of 288.73 g/mol. Its IUPAC name is 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide.

Molecular Properties

Compound Name4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
PubChem CID135445577
Molecular FormulaC15H13ClN2O2
Molecular Weight288.73 g/mol
Exact Mass288.07
IUPAC Name4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
SMILESC/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccccc1O
InChIInChI=1S/C15H13ClN2O2/c1-10(13-4-2-3-5-14(13)19)17-18-15(20)11-6-8-12(16)9-7-11/h2-9,19H,1H3,(H,18,20)/b17-10+
InChIKeyUVCZJHCHDQMFGS-LICLKQGHSA-N
XLogP3.20
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.73
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide?
The IUPAC name of 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide (CID 135445577) is 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide.
What is the SMILES notation for 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide?
The canonical SMILES for 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide is C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccccc1O.
What is the InChIKey of 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide?
The InChIKey is UVCZJHCHDQMFGS-LICLKQGHSA-N. The full InChI is InChI=1S/C15H13ClN2O2/c1-10(13-4-2-3-5-14(13)19)17-18-15(20)11-6-8-12(16)9-7-11/h2-9,19H,1H3,(H,18,20)/b17-10+.
What are the key properties of 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide?
4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide has a molecular weight of 288.73 g/mol, XLogP of 3.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide is sourced from PubChem (CID 135445577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).