About 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide
2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide (PubChem CID 47022974) has the molecular formula C15H19NO2
and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide.
Molecular Properties
| Compound Name | 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide |
| PubChem CID | 47022974 |
| Molecular Formula | C15H19NO2 |
| Molecular Weight | 245.32 g/mol |
| Exact Mass | 245.14 |
| IUPAC Name | 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide |
| SMILES | O=C(CC1C=CCC1)N(Cc1ccco1)C1CC1 |
| InChI | InChI=1S/C15H19NO2/c17-15(10-12-4-1-2-5-12)16(13-7-8-13)11-14-6-3-9-18-14/h1,3-4,6,9,12-13H,2,5,7-8,10-11H2 |
| InChIKey | MWLYXCLMLUWVJQ-UHFFFAOYSA-N |
| XLogP | 3.13 |
| TPSA | 33.45 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 245.32 |
| LogP ≤ 5 | 3.13 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide (CID 47022974) is 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide is O=C(CC1C=CCC1)N(Cc1ccco1)C1CC1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide?
The InChIKey is MWLYXCLMLUWVJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c17-15(10-12-4-1-2-5-12)16(13-7-8-13)11-14-6-3-9-18-14/h1,3-4,6,9,12-13H,2,5,7-8,10-11H2.
What are the key properties of 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide?
2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide has a molecular weight of 245.32 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 47022974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).