Acetone → N-(1-methylethyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethylamine

HRID 664682Notes

Reaction equation

HRID 664682 reaction equation
[C:27]([BH3-:28])#[N:29].[C:33]([BH3-:34])#[N:35].[CH3:16][C:17]([CH3:18])=[O:19].[CH3:25][OH:26].[Cl-:31].[Cl-:36].[Cl:20][CH2:21][Cl:22].[Na+:24].[Na+:30].[OH-:23].[Zn+2:32].[Zn+2:37].[n:1]1[c:2]([N:7]2[CH2:8][CH2:9][N:10]([CH2:13][CH2:14][NH2:15])[CH2:11][CH2:12]2)[n:3][cH:4][cH:5][cH:6]1>>[n:1]1[c:2]([N:7]2[CH2:8][CH2:9][N:10]([CH2:13][CH2:14][NH:15][CH:17]([CH3:16])[CH3:18])[CH2:11][CH2:12]2)[n:3][cH:4][cH:5][cH:6]1

Participants

10

Reactant 9

HCID 180AcetoneHCID 312Chloride2×HCID 887MethanolHCID 923Sodium ion2×HCID 961HydroxideHCID 6344DichloromethaneHCID 32051Zinc(2+)2×HCID 498716Cyano-borohydride2×HCID 138853581-Piperazineethanamine, 4-(2-pyrimidinyl)-

Product 1

HCID 10682089N-(1-methylethyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethylamine

Sources & evidence

ORD record
ord-f6698a8b38ca44ea8d19d0c46766ca73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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