Dimethylformamide → methyl 4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c]pyrazin-2-yl)benzoate

HRID 1138397Notes

Reaction equation

HRID 1138397 reaction equation
[C:12](=[O:13])([O-:14])[O-:15].[C:18]([CH:19]1[CH2:20][CH2:21][CH2:22][CH2:23][C:24]1=[O:25])(=[O:26])[CH3:27].[CH2:28]1[CH:29]2[N:30]([CH2:31][CH2:32][NH:33]1)[CH2:34][CH2:35][CH2:36]2.[Cs+:16].[Cs+:17].[Cu:42][I:43].[I:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1.[O:37]=[CH:38][N:39]([CH3:40])[CH3:41]>>[c:2]1([N:33]2[CH2:28][CH:29]3[N:30]([CH2:31][CH2:32]2)[CH2:34][CH2:35][CH2:36]3)[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 134002-AcetylcyclohexanoneHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 69273Methyl 4-iodobenzoateHCID 104967Cesium cation2×HCID 558578Octahydropyrrolo(1,2-a)pyrazine

Product 1

HCID 66589871methyl 4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c]pyrazin-2-yl)benzoate

Sources & evidence

ORD record
ord-df12a688898d490194532cd257d4c699
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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