About 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine
1,4-bis[(Z)-2-methylbut-1-enyl]piperazine (PubChem CID 88614565) has the molecular formula C14H26N2
and a molecular weight of 222.38 g/mol. Its IUPAC name is 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine.
Molecular Properties
| Compound Name | 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine |
| PubChem CID | 88614565 |
| Molecular Formula | C14H26N2 |
| Molecular Weight | 222.38 g/mol |
| Exact Mass | 222.21 |
| IUPAC Name | 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine |
| SMILES | CC/C(C)=C\N1CCN(/C=C(/C)CC)CC1 |
| InChI | InChI=1S/C14H26N2/c1-5-13(3)11-15-7-9-16(10-8-15)12-14(4)6-2/h11-12H,5-10H2,1-4H3/b13-11-,14-12- |
| InChIKey | WODBKPQQDSEXCU-XSYHWHKQSA-N |
| XLogP | 3.23 |
| TPSA | 6.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 222.38 |
| LogP ≤ 5 | 3.23 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine?
The IUPAC name of 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine (CID 88614565) is 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine.
What is the SMILES notation for 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine?
The canonical SMILES for 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine is CC/C(C)=C\N1CCN(/C=C(/C)CC)CC1.
What is the InChIKey of 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine?
The InChIKey is WODBKPQQDSEXCU-XSYHWHKQSA-N. The full InChI is InChI=1S/C14H26N2/c1-5-13(3)11-15-7-9-16(10-8-15)12-14(4)6-2/h11-12H,5-10H2,1-4H3/b13-11-,14-12-.
What are the key properties of 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine?
1,4-bis[(Z)-2-methylbut-1-enyl]piperazine has a molecular weight of 222.38 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis[(Z)-2-methylbut-1-enyl]piperazine is sourced from PubChem (CID 88614565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).