About (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol
(4-ethylcyclohexyl)-(4-methoxyphenyl)methanol (PubChem CID 64749359) has the molecular formula C16H24O2
and a molecular weight of 248.37 g/mol. Its IUPAC name is (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol.
Molecular Properties
| Compound Name | (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol |
| PubChem CID | 64749359 |
| Molecular Formula | C16H24O2 |
| Molecular Weight | 248.37 g/mol |
| Exact Mass | 248.18 |
| IUPAC Name | (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol |
| SMILES | CCC1CCC(C(O)c2ccc(OC)cc2)CC1 |
| InChI | InChI=1S/C16H24O2/c1-3-12-4-6-13(7-5-12)16(17)14-8-10-15(18-2)11-9-14/h8-13,16-17H,3-7H2,1-2H3 |
| InChIKey | PRASLACFRDODNA-UHFFFAOYSA-N |
| XLogP | 3.94 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 248.37 |
| LogP ≤ 5 | 3.94 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol?
The IUPAC name of (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol (CID 64749359) is (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol.
What is the SMILES notation for (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol?
The canonical SMILES for (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol is CCC1CCC(C(O)c2ccc(OC)cc2)CC1.
What is the InChIKey of (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol?
The InChIKey is PRASLACFRDODNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O2/c1-3-12-4-6-13(7-5-12)16(17)14-8-10-15(18-2)11-9-14/h8-13,16-17H,3-7H2,1-2H3.
What are the key properties of (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol?
(4-ethylcyclohexyl)-(4-methoxyphenyl)methanol has a molecular weight of 248.37 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylcyclohexyl)-(4-methoxyphenyl)methanol is sourced from PubChem (CID 64749359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).