2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan

C15H16O — CID 100992434

IUPAC2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan
SMILESCC(C)c1ccc(/C=C/c2ccco2)cc1
InChIInChI=1S/C15H16O/c1-12(2)14-8-5-13(6-9-14)7-10-15-4-3-11-16-15/h3-12H,1-2H3/b10-7+
InChIKeyMZFRCXFLYPJBBT-JXMROGBWSA-N
MW212.29 g/mol
LogP4.57
Rot. Bonds3

About 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan

2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan (PubChem CID 100992434) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan.

Molecular Properties

Compound Name2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan
PubChem CID100992434
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan
SMILESCC(C)c1ccc(/C=C/c2ccco2)cc1
InChIInChI=1S/C15H16O/c1-12(2)14-8-5-13(6-9-14)7-10-15-4-3-11-16-15/h3-12H,1-2H3/b10-7+
InChIKeyMZFRCXFLYPJBBT-JXMROGBWSA-N
XLogP4.57
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan 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-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan?
The IUPAC name of 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan (CID 100992434) is 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan.
What is the SMILES notation for 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan?
The canonical SMILES for 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan is CC(C)c1ccc(/C=C/c2ccco2)cc1.
What is the InChIKey of 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan?
The InChIKey is MZFRCXFLYPJBBT-JXMROGBWSA-N. The full InChI is InChI=1S/C15H16O/c1-12(2)14-8-5-13(6-9-14)7-10-15-4-3-11-16-15/h3-12H,1-2H3/b10-7+.
What are the key properties of 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan?
2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan has a molecular weight of 212.29 g/mol, XLogP of 4.57, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]furan is sourced from PubChem (CID 100992434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).