About 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine (PubChem CID 63169631) has the molecular formula C16H31N3
and a molecular weight of 265.44 g/mol. Its IUPAC name is 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine.
Molecular Properties
| Compound Name | 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine |
| PubChem CID | 63169631 |
| Molecular Formula | C16H31N3 |
| Molecular Weight | 265.44 g/mol |
| Exact Mass | 265.25 |
| IUPAC Name | 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine |
| SMILES | NCC(C1CCCC1)N1CCC(N2CCCCC2)C1 |
| InChI | InChI=1S/C16H31N3/c17-12-16(14-6-2-3-7-14)19-11-8-15(13-19)18-9-4-1-5-10-18/h14-16H,1-13,17H2 |
| InChIKey | VAJOEPHDAQYNBU-UHFFFAOYSA-N |
| XLogP | 2.06 |
| TPSA | 32.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 265.44 |
| LogP ≤ 5 | 2.06 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine?
The IUPAC name of 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine (CID 63169631) is 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine?
The canonical SMILES for 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine is NCC(C1CCCC1)N1CCC(N2CCCCC2)C1.
What is the InChIKey of 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine?
The InChIKey is VAJOEPHDAQYNBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c17-12-16(14-6-2-3-7-14)19-11-8-15(13-19)18-9-4-1-5-10-18/h14-16H,1-13,17H2.
What are the key properties of 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine?
2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine has a molecular weight of 265.44 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine is sourced from PubChem (CID 63169631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).