2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide

C14H12N2O3 — CID 6893640

IUPAC2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide
SMILESO=C(N/N=C/c1cccc(O)c1)c1ccccc1O
InChIInChI=1S/C14H12N2O3/c17-11-5-3-4-10(8-11)9-15-16-14(19)12-6-1-2-7-13(12)18/h1-9,17-18H,(H,16,19)/b15-9+
InChIKeyAXQNMXSAYHDNGA-OQLLNIDSSA-N
MW256.26 g/mol
LogP1.86
Rot. Bonds3

About 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide

2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide (PubChem CID 6893640) has the molecular formula C14H12N2O3 and a molecular weight of 256.26 g/mol. Its IUPAC name is 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide
PubChem CID6893640
Molecular FormulaC14H12N2O3
Molecular Weight256.26 g/mol
Exact Mass256.08
IUPAC Name2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide
SMILESO=C(N/N=C/c1cccc(O)c1)c1ccccc1O
InChIInChI=1S/C14H12N2O3/c17-11-5-3-4-10(8-11)9-15-16-14(19)12-6-1-2-7-13(12)18/h1-9,17-18H,(H,16,19)/b15-9+
InChIKeyAXQNMXSAYHDNGA-OQLLNIDSSA-N
XLogP1.86
TPSA81.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 51.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-hydroxy-N-[(E)-(3-hydroxyphenyl)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

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide?
The IUPAC name of 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide (CID 6893640) is 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide.
What is the SMILES notation for 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide?
The canonical SMILES for 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide is O=C(N/N=C/c1cccc(O)c1)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide?
The InChIKey is AXQNMXSAYHDNGA-OQLLNIDSSA-N. The full InChI is InChI=1S/C14H12N2O3/c17-11-5-3-4-10(8-11)9-15-16-14(19)12-6-1-2-7-13(12)18/h1-9,17-18H,(H,16,19)/b15-9+.
What are the key properties of 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide?
2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide has a molecular weight of 256.26 g/mol, XLogP of 1.86, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(E)-(3-hydroxyphenyl)methylideneamino]benzamide is sourced from PubChem (CID 6893640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).