About 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol
2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol (PubChem CID 102966062) has the molecular formula C15H29NO2
and a molecular weight of 255.40 g/mol. Its IUPAC name is 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol.
Molecular Properties
| Compound Name | 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol |
| PubChem CID | 102966062 |
| Molecular Formula | C15H29NO2 |
| Molecular Weight | 255.40 g/mol |
| Exact Mass | 255.22 |
| IUPAC Name | 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol |
| SMILES | COC1CN(C2CCCCCCC2O)CCC1C |
| InChI | InChI=1S/C15H29NO2/c1-12-9-10-16(11-15(12)18-2)13-7-5-3-4-6-8-14(13)17/h12-15,17H,3-11H2,1-2H3 |
| InChIKey | OETPKNPWYFTCGH-UHFFFAOYSA-N |
| XLogP | 2.43 |
| TPSA | 32.70 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 255.40 |
| LogP ≤ 5 | 2.43 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol?
The IUPAC name of 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol (CID 102966062) is 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol.
What is the SMILES notation for 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol?
The canonical SMILES for 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol is COC1CN(C2CCCCCCC2O)CCC1C.
What is the InChIKey of 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol?
The InChIKey is OETPKNPWYFTCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-12-9-10-16(11-15(12)18-2)13-7-5-3-4-6-8-14(13)17/h12-15,17H,3-11H2,1-2H3.
What are the key properties of 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol?
2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol has a molecular weight of 255.40 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-4-methylpiperidin-1-yl)cyclooctan-1-ol is sourced from PubChem (CID 102966062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).