About 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol
2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol (PubChem CID 116712860) has the molecular formula C15H28O2
and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol.
Molecular Properties
| Compound Name | 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol |
| PubChem CID | 116712860 |
| Molecular Formula | C15H28O2 |
| Molecular Weight | 240.39 g/mol |
| Exact Mass | 240.21 |
| IUPAC Name | 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol |
| SMILES | CCOC(C1CC1)C(O)C1CCC(CC)CC1 |
| InChI | InChI=1S/C15H28O2/c1-3-11-5-7-12(8-6-11)14(16)15(17-4-2)13-9-10-13/h11-16H,3-10H2,1-2H3 |
| InChIKey | COPVXYROXBLIIO-UHFFFAOYSA-N |
| XLogP | 3.38 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| 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 |
Analyze 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol?
The IUPAC name of 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol (CID 116712860) is 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol.
What is the SMILES notation for 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol?
The canonical SMILES for 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol is CCOC(C1CC1)C(O)C1CCC(CC)CC1.
What is the InChIKey of 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol?
The InChIKey is COPVXYROXBLIIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-3-11-5-7-12(8-6-11)14(16)15(17-4-2)13-9-10-13/h11-16H,3-10H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol?
2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol has a molecular weight of 240.39 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-ethoxy-1-(4-ethylcyclohexyl)ethanol is sourced from PubChem (CID 116712860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).