C15H16BrN3O — CID 104654165
5-(5-bromofuran-2-yl)-5-methyl-1-(2-methylphenyl)-4H-imidazol-2-amine (PubChem CID 104654165) has the molecular formula C15H16BrN3O and a molecular weight of 334.22 g/mol. Its IUPAC name is 5-(5-bromofuran-2-yl)-5-methyl-1-(2-methylphenyl)-4H-imidazol-2-amine.
| Compound Name | 5-(5-bromofuran-2-yl)-5-methyl-1-(2-methylphenyl)-4H-imidazol-2-amine |
|---|---|
| PubChem CID | 104654165 |
| Molecular Formula | C15H16BrN3O |
| Molecular Weight | 334.22 g/mol |
| Exact Mass | 333.05 |
| IUPAC Name | 5-(5-bromofuran-2-yl)-5-methyl-1-(2-methylphenyl)-4H-imidazol-2-amine |
| SMILES | Cc1ccccc1N1C(N)=NCC1(C)c1ccc(Br)o1 |
| InChI | InChI=1S/C15H16BrN3O/c1-10-5-3-4-6-11(10)19-14(17)18-9-15(19,2)12-7-8-13(16)20-12/h3-8H,9H2,1-2H3,(H2,17,18) |
| InChIKey | VSUHUDMVHLXZPE-UHFFFAOYSA-N |
| XLogP | 3.40 |
| TPSA | 54.76 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 20 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 334.22 |
| LogP ≤ 5 | 3.40 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |