Potassium Cation → 4-(3,5-Dimethylpyridin-2-yl)piperazine-1-carboxylic acid tert-butyl ester

Reaction equation

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15][cH:16][c:17]([Br:21])[cH:18][c:19]2[CH3:20])[CH2:12][CH2:13]1.[CH3:22][B:23]([OH:24])[OH:25].[F-:26].[K+:27].[O:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1.[OH2:33]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15][cH:16][c:17]([CH3:22])[cH:18][c:19]2[CH3:20])[CH2:12][CH2:13]1

Participants

Reactant 6

HCID 813Potassium Cation

HCID 962Water

HCID 8028Tetrahydrofuran

HCID 28179Fluoride Ion

HCID 139377Methylboronic Acid

HCID 46739269tert-Butyl 4-(5-bromo-3-methylpyridin-2-yl)piperazine-1-carboxylate

Product 1

HCID 673812824-(3,5-Dimethylpyridin-2-yl)piperazine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record: ord-e7d61a0391d54b68878716ff875f56eb
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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