About 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine
2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine (PubChem CID 79568585) has the molecular formula C13H26N2O
and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine.
Molecular Properties
| Compound Name | 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine |
| PubChem CID | 79568585 |
| Molecular Formula | C13H26N2O |
| Molecular Weight | 226.36 g/mol |
| Exact Mass | 226.20 |
| IUPAC Name | 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine |
| SMILES | CCOCC(N)C1(N2CCCC2)CCCC1 |
| InChI | InChI=1S/C13H26N2O/c1-2-16-11-12(14)13(7-3-4-8-13)15-9-5-6-10-15/h12H,2-11,14H2,1H3 |
| InChIKey | HTCIQVFAGFUMIT-UHFFFAOYSA-N |
| XLogP | 1.76 |
| TPSA | 38.49 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.36 |
| LogP ≤ 5 | 1.76 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine?
The IUPAC name of 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine (CID 79568585) is 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine.
What is the SMILES notation for 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine?
The canonical SMILES for 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine is CCOCC(N)C1(N2CCCC2)CCCC1.
What is the InChIKey of 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine?
The InChIKey is HTCIQVFAGFUMIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-16-11-12(14)13(7-3-4-8-13)15-9-5-6-10-15/h12H,2-11,14H2,1H3.
What are the key properties of 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine?
2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine has a molecular weight of 226.36 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(1-pyrrolidin-1-ylcyclopentyl)ethanamine is sourced from PubChem (CID 79568585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).