C12H11N5O2 — CID 108812161
1-(1H-indazol-6-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea (PubChem CID 108812161) has the molecular formula C12H11N5O2 and a molecular weight of 257.25 g/mol. Its IUPAC name is 1-(1H-indazol-6-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea.
| Compound Name | 1-(1H-indazol-6-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea |
|---|---|
| PubChem CID | 108812161 |
| Molecular Formula | C12H11N5O2 |
| Molecular Weight | 257.25 g/mol |
| Exact Mass | 257.09 |
| IUPAC Name | 1-(1H-indazol-6-yl)-3-(5-methyl-1,2-oxazol-3-yl)urea |
| SMILES | Cc1cc(NC(=O)Nc2ccc3cn[nH]c3c2)no1 |
| InChI | InChI=1S/C12H11N5O2/c1-7-4-11(17-19-7)15-12(18)14-9-3-2-8-6-13-16-10(8)5-9/h2-6H,1H3,(H,13,16)(H2,14,15,17,18) |
| InChIKey | LOSHYKQBGFFVHW-UHFFFAOYSA-N |
| XLogP | 2.50 |
| TPSA | 95.84 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 257.25 |
| LogP ≤ 5 | 2.50 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |