About 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol
2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol (PubChem CID 114157781) has the molecular formula C15H28O2
and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol.
Molecular Properties
| Compound Name | 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol |
| PubChem CID | 114157781 |
| Molecular Formula | C15H28O2 |
| Molecular Weight | 240.39 g/mol |
| Exact Mass | 240.21 |
| IUPAC Name | 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol |
| SMILES | CC(C)C1CCC(O)C(OCCC2CCC2)C1 |
| InChI | InChI=1S/C15H28O2/c1-11(2)13-6-7-14(16)15(10-13)17-9-8-12-4-3-5-12/h11-16H,3-10H2,1-2H3 |
| InChIKey | OYVKEKVSKVDVTM-UHFFFAOYSA-N |
| XLogP | 3.38 |
| 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 | 3.38 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol (CID 114157781) is 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol is CC(C)C1CCC(O)C(OCCC2CCC2)C1.
What is the InChIKey of 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is OYVKEKVSKVDVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-11(2)13-6-7-14(16)15(10-13)17-9-8-12-4-3-5-12/h11-16H,3-10H2,1-2H3.
What are the key properties of 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol?
2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 114157781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).