N,N-Dimethylglycine → 5-(4-fluorophenyl)-2-(pyridin-3-yloxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one

HRID 1567487Notes

Reaction equation

HRID 1567487 reaction equation
[Br:20][c:21]1[cH:22][n:23][cH:24][cH:25][cH:26]1.[C:27](=[O:28])([O-:29])[O-:30].[CH2:40]1[O:41][CH2:42][CH2:43][O:44][CH2:45]1.[CH3:33][N:34]([CH2:35][C:36](=[O:37])[OH:38])[CH3:39].[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[Cs+:31].[Cs+:32].[Cu:52][I:53].[F:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[C:9](=[O:19])[c:10]3[n:11]([n:14][c:15]([CH2:17][OH:18])[cH:16]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[C:9](=[O:19])[c:10]3[n:11]([n:14][c:15]([CH2:17][O:18][c:21]4[cH:22][n:23][cH:24][cH:25][cH:26]4)[cH:16]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 673N,N-DimethylglycineHCID 8857Ethyl AcetateHCID 122863-BromopyridineHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 679743405-(4-Fluoro-phenyl)-2-hydroxymethyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one

Product 1

HCID 574101415-(4-fluorophenyl)-2-(pyridin-3-yloxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one

Sources & evidence

ORD record
ord-4cc994365f874bc1a71ee5f72ed523a3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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