3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide

C14H12N2O4 — CID 135708473

IUPAC3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide
SMILESO=C(N/N=C\c1ccccc1O)c1cc(O)cc(O)c1
InChIInChI=1S/C14H12N2O4/c17-11-5-10(6-12(18)7-11)14(20)16-15-8-9-3-1-2-4-13(9)19/h1-8,17-19H,(H,16,20)/b15-8-
InChIKeyIJAOYEXCQHKGJI-NVNXTCNLSA-N
MW272.26 g/mol
LogP1.57
Rot. Bonds3

About 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide

3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide (PubChem CID 135708473) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide
PubChem CID135708473
Molecular FormulaC14H12N2O4
Molecular Weight272.26 g/mol
Exact Mass272.08
IUPAC Name3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide
SMILESO=C(N/N=C\c1ccccc1O)c1cc(O)cc(O)c1
InChIInChI=1S/C14H12N2O4/c17-11-5-10(6-12(18)7-11)14(20)16-15-8-9-3-1-2-4-13(9)19/h1-8,17-19H,(H,16,20)/b15-8-
InChIKeyIJAOYEXCQHKGJI-NVNXTCNLSA-N
XLogP1.57
TPSA102.15 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 51.57
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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 3,5-dihydroxy-N-[(Z)-(2-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

Related Compounds

3-hydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]-5-methylbenzamide
CID 172933707
N-[(E)-(2,3-dihydroxyphenyl)methylideneamino]-3,5-dihydroxybenzamide
CID 135421615
N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide
CID 135608250
N-[(Z)-benzylideneamino]-3,5-dihydroxybenzamide
CID 170181665
N-[(2-hydroxyphenyl)methylideneamino]-4-phenylbenzamide
CID 827697
1-N,3-N-bis[(E)-(2-hydroxyphenyl)methylideneamino]-5-[4-[[(E)-(2-hydroxyphenyl)methylideneamino]carbamoyl]phenoxy]benzene-1,3-dicarboxamide
CID 177388501
N-[(E)-(2,3-dihydroxyphenyl)methylideneamino]-3-hydroxybenzamide
CID 135852734
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-4-[4-[[(Z)-(2-hydroxyphenyl)methylideneamino]carbamoyl]phenyl]sulfonylbenzamide
CID 135489914
N-[(E)-(2-hydroxy-5-methylphenyl)methylideneamino]benzamide
CID 135406892
3-(dimethylamino)-N-[(2-hydroxyphenyl)methylideneamino]benzamide
CID 137065890
[4-[[(2-hydroxyphenyl)methylideneamino]carbamoyl]phenyl]-dimethylazanium
CID 146938303
N-[(2-hydroxyphenyl)methylideneamino]-4-methoxybenzamide
CID 584655

Frequently Asked Questions

What is the IUPAC name of 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide?
The IUPAC name of 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide (CID 135708473) is 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide.
What is the SMILES notation for 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide?
The canonical SMILES for 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide is O=C(N/N=C\c1ccccc1O)c1cc(O)cc(O)c1.
What is the InChIKey of 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide?
The InChIKey is IJAOYEXCQHKGJI-NVNXTCNLSA-N. The full InChI is InChI=1S/C14H12N2O4/c17-11-5-10(6-12(18)7-11)14(20)16-15-8-9-3-1-2-4-13(9)19/h1-8,17-19H,(H,16,20)/b15-8-.
What are the key properties of 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide?
3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide has a molecular weight of 272.26 g/mol, XLogP of 1.57, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide is sourced from PubChem (CID 135708473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).