About 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol
6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol (PubChem CID 103738002) has the molecular formula C14H29NO
and a molecular weight of 227.39 g/mol. Its IUPAC name is 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol.
Molecular Properties
| Compound Name | 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol |
| PubChem CID | 103738002 |
| Molecular Formula | C14H29NO |
| Molecular Weight | 227.39 g/mol |
| Exact Mass | 227.22 |
| IUPAC Name | 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol |
| SMILES | CC(C)C1CCN(CCCCCCO)CC1 |
| InChI | InChI=1S/C14H29NO/c1-13(2)14-7-10-15(11-8-14)9-5-3-4-6-12-16/h13-14,16H,3-12H2,1-2H3 |
| InChIKey | SMFKPGGIXTXFJC-UHFFFAOYSA-N |
| XLogP | 2.91 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.39 |
| LogP ≤ 5 | 2.91 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol?
The IUPAC name of 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol (CID 103738002) is 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol.
What is the SMILES notation for 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol?
The canonical SMILES for 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol is CC(C)C1CCN(CCCCCCO)CC1.
What is the InChIKey of 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol?
The InChIKey is SMFKPGGIXTXFJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-13(2)14-7-10-15(11-8-14)9-5-3-4-6-12-16/h13-14,16H,3-12H2,1-2H3.
What are the key properties of 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol?
6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol has a molecular weight of 227.39 g/mol, XLogP of 2.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol is sourced from PubChem (CID 103738002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).