About 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine
1-(2-fluoroethyl)-2-methyl-5-propylpiperazine (PubChem CID 80697266) has the molecular formula C10H21FN2
and a molecular weight of 188.29 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine.
Molecular Properties
| Compound Name | 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine |
| PubChem CID | 80697266 |
| Molecular Formula | C10H21FN2 |
| Molecular Weight | 188.29 g/mol |
| Exact Mass | 188.17 |
| IUPAC Name | 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine |
| SMILES | CCCC1CN(CCF)C(C)CN1 |
| InChI | InChI=1S/C10H21FN2/c1-3-4-10-8-13(6-5-11)9(2)7-12-10/h9-10,12H,3-8H2,1-2H3 |
| InChIKey | AJDYWIZOPOIJJU-UHFFFAOYSA-N |
| XLogP | 1.42 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 188.29 |
| LogP ≤ 5 | 1.42 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine?
The IUPAC name of 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine (CID 80697266) is 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine.
What is the SMILES notation for 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine?
The canonical SMILES for 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine is CCCC1CN(CCF)C(C)CN1.
What is the InChIKey of 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine?
The InChIKey is AJDYWIZOPOIJJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21FN2/c1-3-4-10-8-13(6-5-11)9(2)7-12-10/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine?
1-(2-fluoroethyl)-2-methyl-5-propylpiperazine has a molecular weight of 188.29 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-2-methyl-5-propylpiperazine is sourced from PubChem (CID 80697266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).