HuagongsheHuagongshe Chemistry Print Report · For research reference only
Tert-butyl (2-[(5-bromopyridin-3-yl)amino]ethyl)carbamate
![Tert-butyl (2-[(5-bromopyridin-3-yl)amino]ethyl)carbamate molecular structure](/img/chemical/69918267.png)
Identifiers & Physical Properties
| Molecular formula | C12H18BrN3O2 |
|---|---|
| Average molar mass | 316.19 g/mol |
| Monoisotopic mass | 315.05824 g/mol |
| SMILES | CC(C)(C)OC(=O)NCCNc1cncc(Br)c1 |
| InChIKey | HBKLVLMYGLCWJD-UHFFFAOYSA-N |
| PubChem CID | 69918267 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 63.3 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 6 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 269 |