About 2-(1-propylpiperidin-3-yl)ethanol
2-(1-propylpiperidin-3-yl)ethanol (PubChem CID 22987971) has the molecular formula C10H21NO
and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-(1-propylpiperidin-3-yl)ethanol.
Molecular Properties
| Compound Name | 2-(1-propylpiperidin-3-yl)ethanol |
| PubChem CID | 22987971 |
| Molecular Formula | C10H21NO |
| Molecular Weight | 171.28 g/mol |
| Exact Mass | 171.16 |
| IUPAC Name | 2-(1-propylpiperidin-3-yl)ethanol |
| SMILES | CCCN1CCCC(CCO)C1 |
| InChI | InChI=1S/C10H21NO/c1-2-6-11-7-3-4-10(9-11)5-8-12/h10,12H,2-9H2,1H3 |
| InChIKey | VYFZAYNVTUWHLD-UHFFFAOYSA-N |
| XLogP | 1.49 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 171.28 |
| LogP ≤ 5 | 1.49 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(1-propylpiperidin-3-yl)ethanol?
The IUPAC name of 2-(1-propylpiperidin-3-yl)ethanol (CID 22987971) is 2-(1-propylpiperidin-3-yl)ethanol.
What is the SMILES notation for 2-(1-propylpiperidin-3-yl)ethanol?
The canonical SMILES for 2-(1-propylpiperidin-3-yl)ethanol is CCCN1CCCC(CCO)C1.
What is the InChIKey of 2-(1-propylpiperidin-3-yl)ethanol?
The InChIKey is VYFZAYNVTUWHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-2-6-11-7-3-4-10(9-11)5-8-12/h10,12H,2-9H2,1H3.
What are the key properties of 2-(1-propylpiperidin-3-yl)ethanol?
2-(1-propylpiperidin-3-yl)ethanol has a molecular weight of 171.28 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propylpiperidin-3-yl)ethanol is sourced from PubChem (CID 22987971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).