About 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide
1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 50969594) has the molecular formula C15H22N4O2
and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide.
Molecular Properties
| Compound Name | 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide |
| PubChem CID | 50969594 |
| Molecular Formula | C15H22N4O2 |
| Molecular Weight | 290.37 g/mol |
| Exact Mass | 290.17 |
| IUPAC Name | 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide |
| SMILES | O=C(NCCc1ncc[nH]1)C1CC(=O)N(C2CCCC2)C1 |
| InChI | InChI=1S/C15H22N4O2/c20-14-9-11(10-19(14)12-3-1-2-4-12)15(21)18-6-5-13-16-7-8-17-13/h7-8,11-12H,1-6,9-10H2,(H,16,17)(H,18,21) |
| InChIKey | SWUIPPRVIQGZJC-UHFFFAOYSA-N |
| XLogP | 0.86 |
| TPSA | 78.09 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 290.37 |
| LogP ≤ 5 | 0.86 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide (CID 50969594) is 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide is O=C(NCCc1ncc[nH]1)C1CC(=O)N(C2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is SWUIPPRVIQGZJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c20-14-9-11(10-19(14)12-3-1-2-4-12)15(21)18-6-5-13-16-7-8-17-13/h7-8,11-12H,1-6,9-10H2,(H,16,17)(H,18,21).
What are the key properties of 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide?
1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[2-(1H-imidazol-2-yl)ethyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 50969594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).