About 1-prop-2-enylcyclodecan-1-ol
1-prop-2-enylcyclodecan-1-ol (PubChem CID 102287484) has the molecular formula C13H24O
and a molecular weight of 196.33 g/mol. Its IUPAC name is 1-prop-2-enylcyclodecan-1-ol.
Molecular Properties
| Compound Name | 1-prop-2-enylcyclodecan-1-ol |
| PubChem CID | 102287484 |
| Molecular Formula | C13H24O |
| Molecular Weight | 196.33 g/mol |
| Exact Mass | 196.18 |
| IUPAC Name | 1-prop-2-enylcyclodecan-1-ol |
| SMILES | C=CCC1(O)CCCCCCCCC1 |
| InChI | InChI=1S/C13H24O/c1-2-10-13(14)11-8-6-4-3-5-7-9-12-13/h2,14H,1,3-12H2 |
| InChIKey | BLFXQGZLBYFWDS-UHFFFAOYSA-N |
| XLogP | 3.82 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 196.33 |
| LogP ≤ 5 | 3.82 |
| 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 1-prop-2-enylcyclodecan-1-ol?
The IUPAC name of 1-prop-2-enylcyclodecan-1-ol (CID 102287484) is 1-prop-2-enylcyclodecan-1-ol.
What is the SMILES notation for 1-prop-2-enylcyclodecan-1-ol?
The canonical SMILES for 1-prop-2-enylcyclodecan-1-ol is C=CCC1(O)CCCCCCCCC1.
What is the InChIKey of 1-prop-2-enylcyclodecan-1-ol?
The InChIKey is BLFXQGZLBYFWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O/c1-2-10-13(14)11-8-6-4-3-5-7-9-12-13/h2,14H,1,3-12H2.
What are the key properties of 1-prop-2-enylcyclodecan-1-ol?
1-prop-2-enylcyclodecan-1-ol has a molecular weight of 196.33 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-2-enylcyclodecan-1-ol is sourced from PubChem (CID 102287484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).