About 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol
6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol (PubChem CID 103166432) has the molecular formula C11H18O
and a molecular weight of 166.26 g/mol. Its IUPAC name is 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol.
Molecular Properties
| Compound Name | 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol |
| PubChem CID | 103166432 |
| Molecular Formula | C11H18O |
| Molecular Weight | 166.26 g/mol |
| Exact Mass | 166.14 |
| IUPAC Name | 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol |
| SMILES | OC1(CC2CCC2)C2CCCC21 |
| InChI | InChI=1S/C11H18O/c12-11(7-8-3-1-4-8)9-5-2-6-10(9)11/h8-10,12H,1-7H2 |
| InChIKey | JPLYQWDQJNOFLF-UHFFFAOYSA-N |
| XLogP | 2.34 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 166.26 |
| LogP ≤ 5 | 2.34 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol?
The IUPAC name of 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol (CID 103166432) is 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol.
What is the SMILES notation for 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol?
The canonical SMILES for 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol is OC1(CC2CCC2)C2CCCC21.
What is the InChIKey of 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol?
The InChIKey is JPLYQWDQJNOFLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O/c12-11(7-8-3-1-4-8)9-5-2-6-10(9)11/h8-10,12H,1-7H2.
What are the key properties of 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol?
6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol has a molecular weight of 166.26 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclobutylmethyl)bicyclo[3.1.0]hexan-6-ol is sourced from PubChem (CID 103166432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).