HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 500499Generated: October 25, 2026
3,3-Dimethyl-1-(9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl)-2-butanone → 4-{2-[7-(3,3-Dimethyl-2-oxobutyl)-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl}benzonitrile
https://huagongshe.com/reaction/500499
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 3,3-Dimethyl-1-(9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl)-2-butanone | HCID 18540398 | — |
| Reactant | 4-Cyanophenethyl methanesulfonate | HCID 22632648 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | 4-{2-[7-(3,3-Dimethyl-2-oxobutyl)-9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl]ethyl}benzonitrile | HCID 9841589 | 95% |
Reaction Steps
A mixture of 3,3-dimethyl-1-(9-oxa-3,7-diazabicyclo[3.3.1]non-3-yl)-2-butanone (from step (ii) above; 56 mg, 0.25 mmol), TEA (0.35 mL, 2.5 mmol) and MeCN (2 mL) was treated with 4-cyanophenethyl methanesulfonate (see step (iii) above; 84 mg, 0.37 mmol). The resulting mixture was stirred at 50° C. for 24 h. The solvents were removed by evaporation, the crude product was dissolved in DCM and then the solution was added to an ion-exchange solid-phase extraction plug (2 g, CBA (carboxylic acid on silica support)). After 1 h, the plug was washed with DCM (15 mL), after which the product was finally eluted with DCM:MeOH:TEA (90:5:5), to give 84 mg (95%) of the title compound.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US07772229B2 |
|---|
| Source dataset | uspto-grants-2010_08 |
|---|
| ORD ID | ord-b2b7737430a54f39ba2e9e2cda761d19 |
|---|
| Source note | uspto-grants-2010_08 |
|---|