About 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol
2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol (PubChem CID 70985802) has the molecular formula C14H26O2
and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol.
Molecular Properties
| Compound Name | 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol |
| PubChem CID | 70985802 |
| Molecular Formula | C14H26O2 |
| Molecular Weight | 226.36 g/mol |
| Exact Mass | 226.19 |
| IUPAC Name | 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol |
| SMILES | CC1CCCCC1C1C[C@@H](CCO)C(C)O1 |
| InChI | InChI=1S/C14H26O2/c1-10-5-3-4-6-13(10)14-9-12(7-8-15)11(2)16-14/h10-15H,3-9H2,1-2H3/t10?,11?,12-,13?,14?/m1/s1 |
| InChIKey | WPZSVSQTCUFPIU-XHLRWWMNSA-N |
| XLogP | 2.99 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.36 |
| LogP ≤ 5 | 2.99 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol?
The IUPAC name of 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol (CID 70985802) is 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol.
What is the SMILES notation for 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol?
The canonical SMILES for 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol is CC1CCCCC1C1C[C@@H](CCO)C(C)O1.
What is the InChIKey of 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol?
The InChIKey is WPZSVSQTCUFPIU-XHLRWWMNSA-N. The full InChI is InChI=1S/C14H26O2/c1-10-5-3-4-6-13(10)14-9-12(7-8-15)11(2)16-14/h10-15H,3-9H2,1-2H3/t10?,11?,12-,13?,14?/m1/s1.
What are the key properties of 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol?
2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol has a molecular weight of 226.36 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol is sourced from PubChem (CID 70985802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).