About (R)-cycloheptyl(phenyl)methanol
(R)-cycloheptyl(phenyl)methanol (PubChem CID 94502427) has the molecular formula C14H20O
and a molecular weight of 204.31 g/mol. Its IUPAC name is (R)-cycloheptyl(phenyl)methanol.
Molecular Properties
| Compound Name | (R)-cycloheptyl(phenyl)methanol |
| PubChem CID | 94502427 |
| Molecular Formula | C14H20O |
| Molecular Weight | 204.31 g/mol |
| Exact Mass | 204.15 |
| IUPAC Name | (R)-cycloheptyl(phenyl)methanol |
| SMILES | O[C@@H](c1ccccc1)C1CCCCCC1 |
| InChI | InChI=1S/C14H20O/c15-14(13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h3,6-7,10-12,14-15H,1-2,4-5,8-9H2/t14-/m1/s1 |
| InChIKey | HSSZAHQNEPIIBG-CQSZACIVSA-N |
| XLogP | 3.69 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 204.31 |
| LogP ≤ 5 | 3.69 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of (R)-cycloheptyl(phenyl)methanol?
The IUPAC name of (R)-cycloheptyl(phenyl)methanol (CID 94502427) is (R)-cycloheptyl(phenyl)methanol.
What is the SMILES notation for (R)-cycloheptyl(phenyl)methanol?
The canonical SMILES for (R)-cycloheptyl(phenyl)methanol is O[C@@H](c1ccccc1)C1CCCCCC1.
What is the InChIKey of (R)-cycloheptyl(phenyl)methanol?
The InChIKey is HSSZAHQNEPIIBG-CQSZACIVSA-N. The full InChI is InChI=1S/C14H20O/c15-14(13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h3,6-7,10-12,14-15H,1-2,4-5,8-9H2/t14-/m1/s1.
What are the key properties of (R)-cycloheptyl(phenyl)methanol?
(R)-cycloheptyl(phenyl)methanol has a molecular weight of 204.31 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cycloheptyl(phenyl)methanol is sourced from PubChem (CID 94502427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).