About (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol
(1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol (PubChem CID 118858375) has the molecular formula C10H20O
and a molecular weight of 156.27 g/mol. Its IUPAC name is (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol.
Molecular Properties
| Compound Name | (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol |
| PubChem CID | 118858375 |
| Molecular Formula | C10H20O |
| Molecular Weight | 156.27 g/mol |
| Exact Mass | 156.15 |
| IUPAC Name | (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol |
| SMILES | CC1CCC[C@](O)(C(C)C)C1 |
| InChI | InChI=1S/C10H20O/c1-8(2)10(11)6-4-5-9(3)7-10/h8-9,11H,4-7H2,1-3H3/t9?,10-/m1/s1 |
| InChIKey | FLDULGZAEKFCIK-QVDQXJPCSA-N |
| XLogP | 2.58 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 156.27 |
| LogP ≤ 5 | 2.58 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol?
The IUPAC name of (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol (CID 118858375) is (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol is CC1CCC[C@](O)(C(C)C)C1.
What is the InChIKey of (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol?
The InChIKey is FLDULGZAEKFCIK-QVDQXJPCSA-N. The full InChI is InChI=1S/C10H20O/c1-8(2)10(11)6-4-5-9(3)7-10/h8-9,11H,4-7H2,1-3H3/t9?,10-/m1/s1.
What are the key properties of (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol?
(1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-methyl-1-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 118858375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).