About 1-cyclopent-2-en-1-ylcyclohexene
1-cyclopent-2-en-1-ylcyclohexene (PubChem CID 14358731) has the molecular formula C11H16
and a molecular weight of 148.25 g/mol. Its IUPAC name is 1-cyclopent-2-en-1-ylcyclohexene.
Molecular Properties
| Compound Name | 1-cyclopent-2-en-1-ylcyclohexene |
| PubChem CID | 14358731 |
| Molecular Formula | C11H16 |
| Molecular Weight | 148.25 g/mol |
| Exact Mass | 148.13 |
| IUPAC Name | 1-cyclopent-2-en-1-ylcyclohexene |
| SMILES | C1=CC(C2=CCCCC2)CC1 |
| InChI | InChI=1S/C11H16/c1-2-6-10(7-3-1)11-8-4-5-9-11/h4,6,8,11H,1-3,5,7,9H2 |
| InChIKey | FBWLNQYHIUSEDM-UHFFFAOYSA-N |
| XLogP | 3.45 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 148.25 |
| LogP ≤ 5 | 3.45 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopent-2-en-1-ylcyclohexene?
The IUPAC name of 1-cyclopent-2-en-1-ylcyclohexene (CID 14358731) is 1-cyclopent-2-en-1-ylcyclohexene.
What is the SMILES notation for 1-cyclopent-2-en-1-ylcyclohexene?
The canonical SMILES for 1-cyclopent-2-en-1-ylcyclohexene is C1=CC(C2=CCCCC2)CC1.
What is the InChIKey of 1-cyclopent-2-en-1-ylcyclohexene?
The InChIKey is FBWLNQYHIUSEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-2-6-10(7-3-1)11-8-4-5-9-11/h4,6,8,11H,1-3,5,7,9H2.
What are the key properties of 1-cyclopent-2-en-1-ylcyclohexene?
1-cyclopent-2-en-1-ylcyclohexene has a molecular weight of 148.25 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopent-2-en-1-ylcyclohexene is sourced from PubChem (CID 14358731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).