C12H9Br2N3O — CID 107603227
2-amino-N-(2,6-dibromophenyl)pyridine-4-carboxamide (PubChem CID 107603227) has the molecular formula C12H9Br2N3O and a molecular weight of 371.03 g/mol. Its IUPAC name is 2-amino-N-(2,6-dibromophenyl)pyridine-4-carboxamide.
| Compound Name | 2-amino-N-(2,6-dibromophenyl)pyridine-4-carboxamide |
|---|---|
| PubChem CID | 107603227 |
| Molecular Formula | C12H9Br2N3O |
| Molecular Weight | 371.03 g/mol |
| Exact Mass | 368.91 |
| IUPAC Name | 2-amino-N-(2,6-dibromophenyl)pyridine-4-carboxamide |
| SMILES | Nc1cc(C(=O)Nc2c(Br)cccc2Br)ccn1 |
| InChI | InChI=1S/C12H9Br2N3O/c13-8-2-1-3-9(14)11(8)17-12(18)7-4-5-16-10(15)6-7/h1-6H,(H2,15,16)(H,17,18) |
| InChIKey | YAUVQBFPHAZCRX-UHFFFAOYSA-N |
| XLogP | 3.44 |
| TPSA | 68.01 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 371.03 |
| LogP ≤ 5 | 3.44 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |