C13H13FN2O4 — CID 8612963
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(4-fluorophenyl)acetate (PubChem CID 8612963) has the molecular formula C13H13FN2O4 and a molecular weight of 280.25 g/mol. Its IUPAC name is [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(4-fluorophenyl)acetate.
| Compound Name | [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(4-fluorophenyl)acetate |
|---|---|
| PubChem CID | 8612963 |
| Molecular Formula | C13H13FN2O4 |
| Molecular Weight | 280.25 g/mol |
| Exact Mass | 280.09 |
| IUPAC Name | [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(4-fluorophenyl)acetate |
| SMILES | O=C(Cc1ccc(F)cc1)OCC(=O)N1CCNC1=O |
| InChI | InChI=1S/C13H13FN2O4/c14-10-3-1-9(2-4-10)7-12(18)20-8-11(17)16-6-5-15-13(16)19/h1-4H,5-8H2,(H,15,19) |
| InChIKey | LHUZBJSEVMGOAP-UHFFFAOYSA-N |
| XLogP | 0.46 |
| TPSA | 75.71 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 280.25 |
| LogP ≤ 5 | 0.46 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |