About 1-(1-cyclopropylethyl)-3-methylpiperazine
1-(1-cyclopropylethyl)-3-methylpiperazine (PubChem CID 64926432) has the molecular formula C10H20N2
and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-(1-cyclopropylethyl)-3-methylpiperazine.
Molecular Properties
| Compound Name | 1-(1-cyclopropylethyl)-3-methylpiperazine |
| PubChem CID | 64926432 |
| Molecular Formula | C10H20N2 |
| Molecular Weight | 168.28 g/mol |
| Exact Mass | 168.16 |
| IUPAC Name | 1-(1-cyclopropylethyl)-3-methylpiperazine |
| SMILES | CC1CN(C(C)C2CC2)CCN1 |
| InChI | InChI=1S/C10H20N2/c1-8-7-12(6-5-11-8)9(2)10-3-4-10/h8-11H,3-7H2,1-2H3 |
| InChIKey | DFGVGKROYHSLKS-UHFFFAOYSA-N |
| XLogP | 1.08 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 168.28 |
| LogP ≤ 5 | 1.08 |
| 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-cyclopropylethyl)-3-methylpiperazine?
The IUPAC name of 1-(1-cyclopropylethyl)-3-methylpiperazine (CID 64926432) is 1-(1-cyclopropylethyl)-3-methylpiperazine.
What is the SMILES notation for 1-(1-cyclopropylethyl)-3-methylpiperazine?
The canonical SMILES for 1-(1-cyclopropylethyl)-3-methylpiperazine is CC1CN(C(C)C2CC2)CCN1.
What is the InChIKey of 1-(1-cyclopropylethyl)-3-methylpiperazine?
The InChIKey is DFGVGKROYHSLKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-8-7-12(6-5-11-8)9(2)10-3-4-10/h8-11H,3-7H2,1-2H3.
What are the key properties of 1-(1-cyclopropylethyl)-3-methylpiperazine?
1-(1-cyclopropylethyl)-3-methylpiperazine has a molecular weight of 168.28 g/mol, XLogP of 1.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylethyl)-3-methylpiperazine is sourced from PubChem (CID 64926432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).