About 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol
4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol (PubChem CID 65166209) has the molecular formula C15H28O2
and a molecular weight of 240.39 g/mol. Its IUPAC name is 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol.
Molecular Properties
| Compound Name | 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol |
| PubChem CID | 65166209 |
| Molecular Formula | C15H28O2 |
| Molecular Weight | 240.39 g/mol |
| Exact Mass | 240.21 |
| IUPAC Name | 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol |
| SMILES | CCC1CCC(O)C(CCCC2CCCO2)C1 |
| InChI | InChI=1S/C15H28O2/c1-2-12-8-9-15(16)13(11-12)5-3-6-14-7-4-10-17-14/h12-16H,2-11H2,1H3 |
| InChIKey | RHEVXOAIHMNMHF-UHFFFAOYSA-N |
| XLogP | 3.52 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 240.39 |
| LogP ≤ 5 | 3.52 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol?
The IUPAC name of 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol (CID 65166209) is 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol is CCC1CCC(O)C(CCCC2CCCO2)C1.
What is the InChIKey of 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol?
The InChIKey is RHEVXOAIHMNMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-2-12-8-9-15(16)13(11-12)5-3-6-14-7-4-10-17-14/h12-16H,2-11H2,1H3.
What are the key properties of 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol?
4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[3-(oxolan-2-yl)propyl]cyclohexan-1-ol is sourced from PubChem (CID 65166209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).