N,N-Dimethylglycine → HCID 42600096, compound

HRID 687066Notes

Reaction equation

HRID 687066 reaction equation
[B-:1]([F:2])([F:3])([F:4])[F:5].[CH3:53][N:54]([CH2:55][C:56](=[O:57])[OH:58])[CH3:59].[CH3:60][N:61]1[CH2:62][CH2:63][O:64][CH2:65][CH2:66]1.[CH3:67][N:68]1[CH2:69][CH2:70][CH2:71][C:72]1=[O:73].[n:6]1([O+:7]=[C:8]([N:9]([CH3:10])[CH3:11])[N:12]([CH3:13])[CH3:14])[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[n:21][n:22]1.[o:23]1[c:24](-[c:32]2[c:33]([NH2:52])[n:34][cH:35][c:36](-[c:38]3[c:39]([CH2:49][O:50][CH3:51])[n:40][n:41]([CH:43]4[CH2:44][CH2:45][NH:46][CH2:47][CH2:48]4)[cH:42]3)[cH:37]2)[n:25][c:26]2[c:27]1[cH:28][cH:29][cH:30][cH:31]2>>[o:23]1[c:24](-[c:32]2[c:33]([NH2:52])[n:34][cH:35][c:36](-[c:38]3[c:39]([CH2:49][O:50][CH3:51])[n:40][n:41]([CH:43]4[CH2:44][CH2:45][N:46]([C:56]([CH2:55][N:54]([CH3:53])[CH3:59])=[O:57])[CH2:47][CH2:48]4)[cH:42]3)[cH:37]2)[n:25][c:26]2[c:27]1[cH:28][cH:29][cH:30][cH:31]2

Participants

7

Reactant 6

HCID 673N,N-DimethylglycineHCID 79724-MethylmorpholineHCID 13387N-methyl-2-pyrrolidoneHCID 26255TetrafluoroborateHCID 673881403-(1,3-Benzoxazol-2-yl)-5-[3-(methoxymethyl)-1-(4-piperidyl)pyrazol-4-yl]pyridin-2-amineHCID 178484678HCID 178484678, compound

Product 1

HCID 42600096HCID 42600096, compound

Sources & evidence

ORD record
ord-1c8fe53101034e42b4cc633461109fc5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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