About 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine
2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine (PubChem CID 143660411) has the molecular formula C13H23NO
and a molecular weight of 209.33 g/mol. Its IUPAC name is 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine.
Molecular Properties
| Compound Name | 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine |
| PubChem CID | 143660411 |
| Molecular Formula | C13H23NO |
| Molecular Weight | 209.33 g/mol |
| Exact Mass | 209.18 |
| IUPAC Name | 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine |
| SMILES | C=C(OC1CCCC1)C1CCCN1CC |
| InChI | InChI=1S/C13H23NO/c1-3-14-10-6-9-13(14)11(2)15-12-7-4-5-8-12/h12-13H,2-10H2,1H3 |
| InChIKey | FXORRQFUSMNCMX-UHFFFAOYSA-N |
| XLogP | 2.94 |
| TPSA | 12.47 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.33 |
| LogP ≤ 5 | 2.94 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine?
The IUPAC name of 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine (CID 143660411) is 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine.
What is the SMILES notation for 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine?
The canonical SMILES for 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine is C=C(OC1CCCC1)C1CCCN1CC.
What is the InChIKey of 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine?
The InChIKey is FXORRQFUSMNCMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-3-14-10-6-9-13(14)11(2)15-12-7-4-5-8-12/h12-13H,2-10H2,1H3.
What are the key properties of 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine?
2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine has a molecular weight of 209.33 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine is sourced from PubChem (CID 143660411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).