About 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol
1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol (PubChem CID 63908037) has the molecular formula C12H24N2O
and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol.
Molecular Properties
| Compound Name | 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol |
| PubChem CID | 63908037 |
| Molecular Formula | C12H24N2O |
| Molecular Weight | 212.34 g/mol |
| Exact Mass | 212.19 |
| IUPAC Name | 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol |
| SMILES | CC(C)N1CCN(CC(O)C2CC2)CC1 |
| InChI | InChI=1S/C12H24N2O/c1-10(2)14-7-5-13(6-8-14)9-12(15)11-3-4-11/h10-12,15H,3-9H2,1-2H3 |
| InChIKey | AZIGTLMDDNHNNY-UHFFFAOYSA-N |
| XLogP | 0.78 |
| TPSA | 26.71 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 212.34 |
| LogP ≤ 5 | 0.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol?
The IUPAC name of 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol (CID 63908037) is 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol is CC(C)N1CCN(CC(O)C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol?
The InChIKey is AZIGTLMDDNHNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10(2)14-7-5-13(6-8-14)9-12(15)11-3-4-11/h10-12,15H,3-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol?
1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol has a molecular weight of 212.34 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(4-propan-2-ylpiperazin-1-yl)ethanol is sourced from PubChem (CID 63908037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).