C18H22N6O4 — CID 22513270
2-[2-(furan-2-yl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-morpholin-4-ylpropyl)acetamide (PubChem CID 22513270) has the molecular formula C18H22N6O4 and a molecular weight of 386.41 g/mol. Its IUPAC name is 2-[2-(furan-2-yl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-morpholin-4-ylpropyl)acetamide.
| Compound Name | 2-[2-(furan-2-yl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-morpholin-4-ylpropyl)acetamide |
|---|---|
| PubChem CID | 22513270 |
| Molecular Formula | C18H22N6O4 |
| Molecular Weight | 386.41 g/mol |
| Exact Mass | 386.17 |
| IUPAC Name | 2-[2-(furan-2-yl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(3-morpholin-4-ylpropyl)acetamide |
| SMILES | O=C(Cn1ncn2nc(-c3ccco3)cc2c1=O)NCCCN1CCOCC1 |
| InChI | InChI=1S/C18H22N6O4/c25-17(19-4-2-5-22-6-9-27-10-7-22)12-23-18(26)15-11-14(16-3-1-8-28-16)21-24(15)13-20-23/h1,3,8,11,13H,2,4-7,9-10,12H2,(H,19,25) |
| InChIKey | ASMZVFQPOOHSOM-UHFFFAOYSA-N |
| XLogP | -0.01 |
| TPSA | 106.90 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 28 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 386.41 |
| LogP ≤ 5 | -0.01 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 9 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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