About 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine
1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine (PubChem CID 64941532) has the molecular formula C19H38N2
and a molecular weight of 294.53 g/mol. Its IUPAC name is 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine.
Molecular Properties
| Compound Name | 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine |
| PubChem CID | 64941532 |
| Molecular Formula | C19H38N2 |
| Molecular Weight | 294.53 g/mol |
| Exact Mass | 294.30 |
| IUPAC Name | 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine |
| SMILES | CCC1CNC(CC(C)C)CN1C(CC)C1CCCCC1 |
| InChI | InChI=1S/C19H38N2/c1-5-18-13-20-17(12-15(3)4)14-21(18)19(6-2)16-10-8-7-9-11-16/h15-20H,5-14H2,1-4H3 |
| InChIKey | ZVEBALSGGXUVNO-UHFFFAOYSA-N |
| XLogP | 4.44 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 294.53 |
| LogP ≤ 5 | 4.44 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine?
The IUPAC name of 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine (CID 64941532) is 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine?
The canonical SMILES for 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine is CCC1CNC(CC(C)C)CN1C(CC)C1CCCCC1.
What is the InChIKey of 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine?
The InChIKey is ZVEBALSGGXUVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-5-18-13-20-17(12-15(3)4)14-21(18)19(6-2)16-10-8-7-9-11-16/h15-20H,5-14H2,1-4H3.
What are the key properties of 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine?
1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine has a molecular weight of 294.53 g/mol, XLogP of 4.44, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine is sourced from PubChem (CID 64941532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).