About 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol
2-butan-2-yl-5-cyclopentylcyclopentan-1-ol (PubChem CID 22937274) has the molecular formula C14H26O
and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol.
Molecular Properties
| Compound Name | 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol |
| PubChem CID | 22937274 |
| Molecular Formula | C14H26O |
| Molecular Weight | 210.36 g/mol |
| Exact Mass | 210.20 |
| IUPAC Name | 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol |
| SMILES | CCC(C)C1CCC(C2CCCC2)C1O |
| InChI | InChI=1S/C14H26O/c1-3-10(2)12-8-9-13(14(12)15)11-6-4-5-7-11/h10-15H,3-9H2,1-2H3 |
| InChIKey | XYYJEXURXYXKMT-UHFFFAOYSA-N |
| XLogP | 3.61 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 210.36 |
| LogP ≤ 5 | 3.61 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol?
The IUPAC name of 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol (CID 22937274) is 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol.
What is the SMILES notation for 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol?
The canonical SMILES for 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol is CCC(C)C1CCC(C2CCCC2)C1O.
What is the InChIKey of 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol?
The InChIKey is XYYJEXURXYXKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-3-10(2)12-8-9-13(14(12)15)11-6-4-5-7-11/h10-15H,3-9H2,1-2H3.
What are the key properties of 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol?
2-butan-2-yl-5-cyclopentylcyclopentan-1-ol has a molecular weight of 210.36 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol is sourced from PubChem (CID 22937274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).