About 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine (PubChem CID 79069589) has the molecular formula C17H34N2
and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine.
Molecular Properties
| Compound Name | 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine |
| PubChem CID | 79069589 |
| Molecular Formula | C17H34N2 |
| Molecular Weight | 266.47 g/mol |
| Exact Mass | 266.27 |
| IUPAC Name | 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine |
| SMILES | CCNC(CC1CCCC1)C(C)(CC)N1CCCC1 |
| InChI | InChI=1S/C17H34N2/c1-4-17(3,19-12-8-9-13-19)16(18-5-2)14-15-10-6-7-11-15/h15-16,18H,4-14H2,1-3H3 |
| InChIKey | YHEBNQMBIRMGRL-UHFFFAOYSA-N |
| XLogP | 3.81 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 266.47 |
| LogP ≤ 5 | 3.81 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The IUPAC name of 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine (CID 79069589) is 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The canonical SMILES for 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine is CCNC(CC1CCCC1)C(C)(CC)N1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The InChIKey is YHEBNQMBIRMGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-17(3,19-12-8-9-13-19)16(18-5-2)14-15-10-6-7-11-15/h15-16,18H,4-14H2,1-3H3.
What are the key properties of 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine has a molecular weight of 266.47 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine is sourced from PubChem (CID 79069589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).