2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol

C19H20O3 — CID 14282780

IUPAC2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol
SMILESC=CCc1ccc(O)c(-c2cc(CC=C)cc(OC)c2O)c1
InChIInChI=1S/C19H20O3/c1-4-6-13-8-9-17(20)15(10-13)16-11-14(7-5-2)12-18(22-3)19(16)21/h4-5,8-12,20-21H,1-2,6-7H2,3H3
InChIKeyYJYOUDXYGAHCKS-UHFFFAOYSA-N
MW296.37 g/mol
LogP4.23
Rot. Bonds6

About 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol

2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol (PubChem CID 14282780) has the molecular formula C19H20O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol.

Molecular Properties

Compound Name2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol
PubChem CID14282780
Molecular FormulaC19H20O3
Molecular Weight296.37 g/mol
Exact Mass296.14
IUPAC Name2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol
SMILESC=CCc1ccc(O)c(-c2cc(CC=C)cc(OC)c2O)c1
InChIInChI=1S/C19H20O3/c1-4-6-13-8-9-17(20)15(10-13)16-11-14(7-5-2)12-18(22-3)19(16)21/h4-5,8-12,20-21H,1-2,6-7H2,3H3
InChIKeyYJYOUDXYGAHCKS-UHFFFAOYSA-N
XLogP4.23
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol 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-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol?
The IUPAC name of 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol (CID 14282780) is 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol.
What is the SMILES notation for 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol?
The canonical SMILES for 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol is C=CCc1ccc(O)c(-c2cc(CC=C)cc(OC)c2O)c1.
What is the InChIKey of 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol?
The InChIKey is YJYOUDXYGAHCKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O3/c1-4-6-13-8-9-17(20)15(10-13)16-11-14(7-5-2)12-18(22-3)19(16)21/h4-5,8-12,20-21H,1-2,6-7H2,3H3.
What are the key properties of 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol?
2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol has a molecular weight of 296.37 g/mol, XLogP of 4.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-5-prop-2-enylphenyl)-6-methoxy-4-prop-2-enylphenol is sourced from PubChem (CID 14282780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).