About 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine
2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine (PubChem CID 65170422) has the molecular formula C15H28N2O
and a molecular weight of 252.40 g/mol. Its IUPAC name is 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine.
Molecular Properties
| Compound Name | 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine |
| PubChem CID | 65170422 |
| Molecular Formula | C15H28N2O |
| Molecular Weight | 252.40 g/mol |
| Exact Mass | 252.22 |
| IUPAC Name | 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine |
| SMILES | CC1(C2CC2)CNCCN1CCCC1CCCO1 |
| InChI | InChI=1S/C15H28N2O/c1-15(13-6-7-13)12-16-8-10-17(15)9-2-4-14-5-3-11-18-14/h13-14,16H,2-12H2,1H3 |
| InChIKey | ZWSWVUBDLCMORL-UHFFFAOYSA-N |
| XLogP | 2.02 |
| TPSA | 24.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 252.40 |
| LogP ≤ 5 | 2.02 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine?
The IUPAC name of 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine (CID 65170422) is 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine.
What is the SMILES notation for 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine?
The canonical SMILES for 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine is CC1(C2CC2)CNCCN1CCCC1CCCO1.
What is the InChIKey of 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine?
The InChIKey is ZWSWVUBDLCMORL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-15(13-6-7-13)12-16-8-10-17(15)9-2-4-14-5-3-11-18-14/h13-14,16H,2-12H2,1H3.
What are the key properties of 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine?
2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine has a molecular weight of 252.40 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methyl-1-[3-(oxolan-2-yl)propyl]piperazine is sourced from PubChem (CID 65170422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).