2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol

C17H18O — CID 166436804

IUPAC2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol
SMILESCC(C)(O)c1ccccc1/C=C/c1ccccc1
InChIInChI=1S/C17H18O/c1-17(2,18)16-11-7-6-10-15(16)13-12-14-8-4-3-5-9-14/h3-13,18H,1-2H3/b13-12+
InChIKeyGVGPZIJTQDECIU-OUKQBFOZSA-N
MW238.33 g/mol
LogP4.08
Rot. Bonds3

About 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol

2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol (PubChem CID 166436804) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol.

Molecular Properties

Compound Name2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol
PubChem CID166436804
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol
SMILESCC(C)(O)c1ccccc1/C=C/c1ccccc1
InChIInChI=1S/C17H18O/c1-17(2,18)16-11-7-6-10-15(16)13-12-14-8-4-3-5-9-14/h3-13,18H,1-2H3/b13-12+
InChIKeyGVGPZIJTQDECIU-OUKQBFOZSA-N
XLogP4.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol 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-[(E)-2-phenylethenyl]phenyl]propan-2-ol?
The IUPAC name of 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol (CID 166436804) is 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol.
What is the SMILES notation for 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol?
The canonical SMILES for 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol is CC(C)(O)c1ccccc1/C=C/c1ccccc1.
What is the InChIKey of 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol?
The InChIKey is GVGPZIJTQDECIU-OUKQBFOZSA-N. The full InChI is InChI=1S/C17H18O/c1-17(2,18)16-11-7-6-10-15(16)13-12-14-8-4-3-5-9-14/h3-13,18H,1-2H3/b13-12+.
What are the key properties of 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol?
2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol has a molecular weight of 238.33 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol is sourced from PubChem (CID 166436804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).