About N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine
N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine (PubChem CID 60849674) has the molecular formula C11H25N3
and a molecular weight of 199.34 g/mol. Its IUPAC name is N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine.
Molecular Properties
| Compound Name | N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine |
| PubChem CID | 60849674 |
| Molecular Formula | C11H25N3 |
| Molecular Weight | 199.34 g/mol |
| Exact Mass | 199.20 |
| IUPAC Name | N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine |
| SMILES | CCN(CCN1CCNCC1)C(C)C |
| InChI | InChI=1S/C11H25N3/c1-4-14(11(2)3)10-9-13-7-5-12-6-8-13/h11-12H,4-10H2,1-3H3 |
| InChIKey | RJQQLDHMKTUELV-UHFFFAOYSA-N |
| XLogP | 0.62 |
| TPSA | 18.51 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.34 |
| LogP ≤ 5 | 0.62 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine?
The IUPAC name of N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine (CID 60849674) is N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine.
What is the SMILES notation for N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine?
The canonical SMILES for N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine is CCN(CCN1CCNCC1)C(C)C.
What is the InChIKey of N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine?
The InChIKey is RJQQLDHMKTUELV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-4-14(11(2)3)10-9-13-7-5-12-6-8-13/h11-12H,4-10H2,1-3H3.
What are the key properties of N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine?
N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine has a molecular weight of 199.34 g/mol, XLogP of 0.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-piperazin-1-ylethyl)propan-2-amine is sourced from PubChem (CID 60849674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).