HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 12372676Generated: November 5, 2026
3-Benzyl-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetraone
https://huagongshe.com/en/chemical/12372676
Identifiers & Physical Properties
| Molecular formula | C16H16N2O4 |
|---|
| Average molar mass | 300.31 g/mol |
|---|
| Monoisotopic mass | 300.111007 g/mol |
|---|
| SMILES | CC1(C)C2C(=O)NC(=O)C1C(=O)N(Cc1ccccc1)C2=O |
|---|
| InChIKey | GTXXTEGXGYWLDS-UHFFFAOYSA-N |
|---|
| PubChem CID | 12372676 |
|---|
Chemical & Physical Properties
| XLogP | 1.2 |
|---|
| Topological polar surface area | 83.6 |
|---|
| Hydrogen bond donors | 1 |
|---|
| Hydrogen bond acceptors | 4 |
|---|
| Rotatable bonds | 2 |
|---|
| Heavy atoms | 22 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 512 |
|---|
![3-Benzyl-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetraone molecular structure](/img/chemical/12372676.png)