5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol

C14H13NO3 — CID 71679997

IUPAC5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol
SMILESCOc1ccc(/C=N/c2ccccc2O)cc1O
InChIInChI=1S/C14H13NO3/c1-18-14-7-6-10(8-13(14)17)9-15-11-4-2-3-5-12(11)16/h2-9,16-17H,1H3/b15-9+
InChIKeyRDUNFXQXKWUOAB-OQLLNIDSSA-N
MW243.26 g/mol
LogP2.86
Rot. Bonds3

About 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol

5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol (PubChem CID 71679997) has the molecular formula C14H13NO3 and a molecular weight of 243.26 g/mol. Its IUPAC name is 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol.

Molecular Properties

Compound Name5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol
PubChem CID71679997
Molecular FormulaC14H13NO3
Molecular Weight243.26 g/mol
Exact Mass243.09
IUPAC Name5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol
SMILESCOc1ccc(/C=N/c2ccccc2O)cc1O
InChIInChI=1S/C14H13NO3/c1-18-14-7-6-10(8-13(14)17)9-15-11-4-2-3-5-12(11)16/h2-9,16-17H,1H3/b15-9+
InChIKeyRDUNFXQXKWUOAB-OQLLNIDSSA-N
XLogP2.86
TPSA62.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol 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 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol?
The IUPAC name of 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol (CID 71679997) is 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol.
What is the SMILES notation for 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol?
The canonical SMILES for 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol is COc1ccc(/C=N/c2ccccc2O)cc1O.
What is the InChIKey of 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol?
The InChIKey is RDUNFXQXKWUOAB-OQLLNIDSSA-N. The full InChI is InChI=1S/C14H13NO3/c1-18-14-7-6-10(8-13(14)17)9-15-11-4-2-3-5-12(11)16/h2-9,16-17H,1H3/b15-9+.
What are the key properties of 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol?
5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol has a molecular weight of 243.26 g/mol, XLogP of 2.86, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-hydroxyphenyl)iminomethyl]-2-methoxyphenol is sourced from PubChem (CID 71679997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).