About 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine
2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine (PubChem CID 79568704) has the molecular formula C14H29N3
and a molecular weight of 239.41 g/mol. Its IUPAC name is 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine.
Molecular Properties
| Compound Name | 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine |
| PubChem CID | 79568704 |
| Molecular Formula | C14H29N3 |
| Molecular Weight | 239.41 g/mol |
| Exact Mass | 239.24 |
| IUPAC Name | 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine |
| SMILES | CC(C)N1CCN(CCC2CCCC2N)CC1 |
| InChI | InChI=1S/C14H29N3/c1-12(2)17-10-8-16(9-11-17)7-6-13-4-3-5-14(13)15/h12-14H,3-11,15H2,1-2H3 |
| InChIKey | DAAYBWBUQXTVDK-UHFFFAOYSA-N |
| XLogP | 1.53 |
| TPSA | 32.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 239.41 |
| LogP ≤ 5 | 1.53 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine (CID 79568704) is 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine is CC(C)N1CCN(CCC2CCCC2N)CC1.
What is the InChIKey of 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine?
The InChIKey is DAAYBWBUQXTVDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-12(2)17-10-8-16(9-11-17)7-6-13-4-3-5-14(13)15/h12-14H,3-11,15H2,1-2H3.
What are the key properties of 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine?
2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine has a molecular weight of 239.41 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 79568704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).