About 1-cyclohexyloxy-2-prop-2-enylbenzene
1-cyclohexyloxy-2-prop-2-enylbenzene (PubChem CID 14946074) has the molecular formula C15H20O
and a molecular weight of 216.32 g/mol. Its IUPAC name is 1-cyclohexyloxy-2-prop-2-enylbenzene.
Molecular Properties
| Compound Name | 1-cyclohexyloxy-2-prop-2-enylbenzene |
| PubChem CID | 14946074 |
| Molecular Formula | C15H20O |
| Molecular Weight | 216.32 g/mol |
| Exact Mass | 216.15 |
| IUPAC Name | 1-cyclohexyloxy-2-prop-2-enylbenzene |
| SMILES | C=CCc1ccccc1OC1CCCCC1 |
| InChI | InChI=1S/C15H20O/c1-2-8-13-9-6-7-12-15(13)16-14-10-4-3-5-11-14/h2,6-7,9,12,14H,1,3-5,8,10-11H2 |
| InChIKey | TWXBVKKYUCICKU-UHFFFAOYSA-N |
| XLogP | 4.13 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 216.32 |
| LogP ≤ 5 | 4.13 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
|---|
Analyze 1-cyclohexyloxy-2-prop-2-enylbenzene 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 1-cyclohexyloxy-2-prop-2-enylbenzene?
The IUPAC name of 1-cyclohexyloxy-2-prop-2-enylbenzene (CID 14946074) is 1-cyclohexyloxy-2-prop-2-enylbenzene.
What is the SMILES notation for 1-cyclohexyloxy-2-prop-2-enylbenzene?
The canonical SMILES for 1-cyclohexyloxy-2-prop-2-enylbenzene is C=CCc1ccccc1OC1CCCCC1.
What is the InChIKey of 1-cyclohexyloxy-2-prop-2-enylbenzene?
The InChIKey is TWXBVKKYUCICKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O/c1-2-8-13-9-6-7-12-15(13)16-14-10-4-3-5-11-14/h2,6-7,9,12,14H,1,3-5,8,10-11H2.
What are the key properties of 1-cyclohexyloxy-2-prop-2-enylbenzene?
1-cyclohexyloxy-2-prop-2-enylbenzene has a molecular weight of 216.32 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyloxy-2-prop-2-enylbenzene is sourced from PubChem (CID 14946074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).