About 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol
2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol (PubChem CID 63410677) has the molecular formula C17H26O
and a molecular weight of 246.39 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol.
Molecular Properties
| Compound Name | 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol |
| PubChem CID | 63410677 |
| Molecular Formula | C17H26O |
| Molecular Weight | 246.39 g/mol |
| Exact Mass | 246.20 |
| IUPAC Name | 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol |
| SMILES | CCc1ccc(CC(O)C2CCC(C)CC2)cc1 |
| InChI | InChI=1S/C17H26O/c1-3-14-6-8-15(9-7-14)12-17(18)16-10-4-13(2)5-11-16/h6-9,13,16-18H,3-5,10-12H2,1-2H3 |
| InChIKey | LRYYHRBMHAPFRR-UHFFFAOYSA-N |
| XLogP | 3.98 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 246.39 |
| LogP ≤ 5 | 3.98 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol?
The IUPAC name of 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol (CID 63410677) is 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol.
What is the SMILES notation for 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol?
The canonical SMILES for 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol is CCc1ccc(CC(O)C2CCC(C)CC2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol?
The InChIKey is LRYYHRBMHAPFRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O/c1-3-14-6-8-15(9-7-14)12-17(18)16-10-4-13(2)5-11-16/h6-9,13,16-18H,3-5,10-12H2,1-2H3.
What are the key properties of 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol?
2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol has a molecular weight of 246.39 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-1-(4-methylcyclohexyl)ethanol is sourced from PubChem (CID 63410677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).