C13H13N3O2S — CID 90627669
N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide (PubChem CID 90627669) has the molecular formula C13H13N3O2S and a molecular weight of 275.33 g/mol. Its IUPAC name is N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide.
| Compound Name | N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide |
|---|---|
| PubChem CID | 90627669 |
| Molecular Formula | C13H13N3O2S |
| Molecular Weight | 275.33 g/mol |
| Exact Mass | 275.07 |
| IUPAC Name | N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide |
| SMILES | O=C(Nc1ccccc1)N1CC(Oc2nccs2)C1 |
| InChI | InChI=1S/C13H13N3O2S/c17-12(15-10-4-2-1-3-5-10)16-8-11(9-16)18-13-14-6-7-19-13/h1-7,11H,8-9H2,(H,15,17) |
| InChIKey | LIVMNAJHPJWDAQ-UHFFFAOYSA-N |
| XLogP | 2.44 |
| TPSA | 54.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 275.33 |
| LogP ≤ 5 | 2.44 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |