About 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol
2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol (PubChem CID 5376527) has the molecular formula C15H14O2
and a molecular weight of 226.27 g/mol. Its IUPAC name is 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol.
Molecular Properties
| Compound Name | 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol |
| PubChem CID | 5376527 |
| Molecular Formula | C15H14O2 |
| Molecular Weight | 226.27 g/mol |
| Exact Mass | 226.10 |
| IUPAC Name | 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol |
| SMILES | COc1ccc(/C=C/c2ccccc2O)cc1 |
| InChI | InChI=1S/C15H14O2/c1-17-14-10-7-12(8-11-14)6-9-13-4-2-3-5-15(13)16/h2-11,16H,1H3/b9-6+ |
| InChIKey | UKDLGNUAFAIABY-RMKNXTFCSA-N |
| XLogP | 3.57 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.27 |
| LogP ≤ 5 | 3.57 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'stilbene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol?
The IUPAC name of 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol (CID 5376527) is 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol.
What is the SMILES notation for 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol?
The canonical SMILES for 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol is COc1ccc(/C=C/c2ccccc2O)cc1.
What is the InChIKey of 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol?
The InChIKey is UKDLGNUAFAIABY-RMKNXTFCSA-N. The full InChI is InChI=1S/C15H14O2/c1-17-14-10-7-12(8-11-14)6-9-13-4-2-3-5-15(13)16/h2-11,16H,1H3/b9-6+.
What are the key properties of 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol?
2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol has a molecular weight of 226.27 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(4-methoxyphenyl)ethenyl]phenol is sourced from PubChem (CID 5376527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).