About 1-(1-piperidin-3-ylethyl)piperazine
1-(1-piperidin-3-ylethyl)piperazine (PubChem CID 53427915) has the molecular formula C11H23N3
and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-(1-piperidin-3-ylethyl)piperazine.
Molecular Properties
| Compound Name | 1-(1-piperidin-3-ylethyl)piperazine |
| PubChem CID | 53427915 |
| Molecular Formula | C11H23N3 |
| Molecular Weight | 197.33 g/mol |
| Exact Mass | 197.19 |
| IUPAC Name | 1-(1-piperidin-3-ylethyl)piperazine |
| SMILES | CC(C1CCCNC1)N1CCNCC1 |
| InChI | InChI=1S/C11H23N3/c1-10(11-3-2-4-13-9-11)14-7-5-12-6-8-14/h10-13H,2-9H2,1H3 |
| InChIKey | QIQNIADQSAMPIF-UHFFFAOYSA-N |
| XLogP | 0.28 |
| TPSA | 27.30 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 197.33 |
| LogP ≤ 5 | 0.28 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-(1-piperidin-3-ylethyl)piperazine?
The IUPAC name of 1-(1-piperidin-3-ylethyl)piperazine (CID 53427915) is 1-(1-piperidin-3-ylethyl)piperazine.
What is the SMILES notation for 1-(1-piperidin-3-ylethyl)piperazine?
The canonical SMILES for 1-(1-piperidin-3-ylethyl)piperazine is CC(C1CCCNC1)N1CCNCC1.
What is the InChIKey of 1-(1-piperidin-3-ylethyl)piperazine?
The InChIKey is QIQNIADQSAMPIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-10(11-3-2-4-13-9-11)14-7-5-12-6-8-14/h10-13H,2-9H2,1H3.
What are the key properties of 1-(1-piperidin-3-ylethyl)piperazine?
1-(1-piperidin-3-ylethyl)piperazine has a molecular weight of 197.33 g/mol, XLogP of 0.28, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-piperidin-3-ylethyl)piperazine is sourced from PubChem (CID 53427915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).