About (2-ethenylcyclopentyl)methanol
(2-ethenylcyclopentyl)methanol (PubChem CID 13161112) has the molecular formula C8H14O
and a molecular weight of 126.20 g/mol. Its IUPAC name is (2-ethenylcyclopentyl)methanol.
Molecular Properties
| Compound Name | (2-ethenylcyclopentyl)methanol |
| PubChem CID | 13161112 |
| Molecular Formula | C8H14O |
| Molecular Weight | 126.20 g/mol |
| Exact Mass | 126.10 |
| IUPAC Name | (2-ethenylcyclopentyl)methanol |
| SMILES | C=CC1CCCC1CO |
| InChI | InChI=1S/C8H14O/c1-2-7-4-3-5-8(7)6-9/h2,7-9H,1,3-6H2 |
| InChIKey | LXGVQRGBNSVJCF-UHFFFAOYSA-N |
| XLogP | 1.58 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 126.20 |
| LogP ≤ 5 | 1.58 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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 (2-ethenylcyclopentyl)methanol?
The IUPAC name of (2-ethenylcyclopentyl)methanol (CID 13161112) is (2-ethenylcyclopentyl)methanol.
What is the SMILES notation for (2-ethenylcyclopentyl)methanol?
The canonical SMILES for (2-ethenylcyclopentyl)methanol is C=CC1CCCC1CO.
What is the InChIKey of (2-ethenylcyclopentyl)methanol?
The InChIKey is LXGVQRGBNSVJCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-2-7-4-3-5-8(7)6-9/h2,7-9H,1,3-6H2.
What are the key properties of (2-ethenylcyclopentyl)methanol?
(2-ethenylcyclopentyl)methanol has a molecular weight of 126.20 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethenylcyclopentyl)methanol is sourced from PubChem (CID 13161112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).