2-[(3-methoxyphenyl)methylideneamino]phenol

C14H13NO2 — CID 70684459

IUPAC2-[(3-methoxyphenyl)methylideneamino]phenol
SMILESCOc1cccc(/C=N/c2ccccc2O)c1
InChIInChI=1S/C14H13NO2/c1-17-12-6-4-5-11(9-12)10-15-13-7-2-3-8-14(13)16/h2-10,16H,1H3/b15-10+
InChIKeyOJSLTCIQANRIRF-XNTDXEJSSA-N
MW227.26 g/mol
LogP3.15
Rot. Bonds3

About 2-[(3-methoxyphenyl)methylideneamino]phenol

2-[(3-methoxyphenyl)methylideneamino]phenol (PubChem CID 70684459) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-[(3-methoxyphenyl)methylideneamino]phenol.

Molecular Properties

Compound Name2-[(3-methoxyphenyl)methylideneamino]phenol
PubChem CID70684459
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name2-[(3-methoxyphenyl)methylideneamino]phenol
SMILESCOc1cccc(/C=N/c2ccccc2O)c1
InChIInChI=1S/C14H13NO2/c1-17-12-6-4-5-11(9-12)10-15-13-7-2-3-8-14(13)16/h2-10,16H,1H3/b15-10+
InChIKeyOJSLTCIQANRIRF-XNTDXEJSSA-N
XLogP3.15
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyphenyl)methylideneamino]phenol?
The IUPAC name of 2-[(3-methoxyphenyl)methylideneamino]phenol (CID 70684459) is 2-[(3-methoxyphenyl)methylideneamino]phenol.
What is the SMILES notation for 2-[(3-methoxyphenyl)methylideneamino]phenol?
The canonical SMILES for 2-[(3-methoxyphenyl)methylideneamino]phenol is COc1cccc(/C=N/c2ccccc2O)c1.
What is the InChIKey of 2-[(3-methoxyphenyl)methylideneamino]phenol?
The InChIKey is OJSLTCIQANRIRF-XNTDXEJSSA-N. The full InChI is InChI=1S/C14H13NO2/c1-17-12-6-4-5-11(9-12)10-15-13-7-2-3-8-14(13)16/h2-10,16H,1H3/b15-10+.
What are the key properties of 2-[(3-methoxyphenyl)methylideneamino]phenol?
2-[(3-methoxyphenyl)methylideneamino]phenol has a molecular weight of 227.26 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenyl)methylideneamino]phenol is sourced from PubChem (CID 70684459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).