2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione
C15H16FNO3 — CID 15657799
Data last refreshed: (MolForge compound catalog, from PubChem)
About 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione
2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione (PubChem CID 15657799) has the molecular formula C15H16FNO3 and a molecular weight of 277.29 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione.
Molecular Properties
| Compound Name | 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione |
|---|---|
| PubChem CID | 15657799 |
| Molecular Formula | C15H16FNO3 |
| Molecular Weight | 277.29 g/mol |
| Exact Mass | 277.11 |
| IUPAC Name | 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione |
| SMILES | O=C1CC2(CCCC2)C(=O)N1OCc1ccc(F)cc1 |
| InChI | InChI=1S/C15H16FNO3/c16-12-5-3-11(4-6-12)10-20-17-13(18)9-15(14(17)19)7-1-2-8-15/h3-6H,1-2,7-10H2 |
| InChIKey | WZZRBGNRBHVKCZ-UHFFFAOYSA-N |
| XLogP | 2.58 |
| TPSA | 46.61 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 277.29 |
| LogP ≤ 5 | 2.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phthalimide', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
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Sources
- PubChem CID 15657799 — identifiers, structure, computed properties (public domain)
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