3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol

C15H14O3 — CID 5473050

IUPAC3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol
SMILESCOc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
InChIInChI=1S/C15H14O3/c1-18-15-9-12(8-14(17)10-15)3-2-11-4-6-13(16)7-5-11/h2-10,16-17H,1H3/b3-2+
InChIKeyKUWZXOMQXYWKBS-NSCUHMNNSA-N
MW242.27 g/mol
LogP3.28
Rot. Bonds3

About 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol

3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol (PubChem CID 5473050) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol.

Molecular Properties

Compound Name3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol
PubChem CID5473050
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol
SMILESCOc1cc(O)cc(/C=C/c2ccc(O)cc2)c1
InChIInChI=1S/C15H14O3/c1-18-15-9-12(8-14(17)10-15)3-2-11-4-6-13(16)7-5-11/h2-10,16-17H,1H3/b3-2+
InChIKeyKUWZXOMQXYWKBS-NSCUHMNNSA-N
XLogP3.28
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-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 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol?
The IUPAC name of 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol (CID 5473050) is 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol.
What is the SMILES notation for 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol?
The canonical SMILES for 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol is COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1.
What is the InChIKey of 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol?
The InChIKey is KUWZXOMQXYWKBS-NSCUHMNNSA-N. The full InChI is InChI=1S/C15H14O3/c1-18-15-9-12(8-14(17)10-15)3-2-11-4-6-13(16)7-5-11/h2-10,16-17H,1H3/b3-2+.
What are the key properties of 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol?
3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol has a molecular weight of 242.27 g/mol, XLogP of 3.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol is sourced from PubChem (CID 5473050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).