Methanol → 4-Methyl-2-[3-(1-methyl-piperidin-4-yl)-propylamino]-pyrimidine-5-carbonitrile

HRID 1128043Notes

Reaction equation

[CH2:1]([O:2][C:3](=[O:4])[N:5]([CH2:6][CH2:7][CH2:8][CH:9]1[CH2:10][CH2:11][N:12]([CH3:15])[CH2:13][CH2:14]1)[c:16]1[n:17][cH:18][c:19]([C:23]#[N:24])[c:20]([CH3:22])[n:21]1)[CH3:25].[CH3:28][OH:29].[Na+:27].[OH-:26]>>[NH:5]([CH2:6][CH2:7][CH2:8][CH:9]1[CH2:10][CH2:11][N:12]([CH3:15])[CH2:13][CH2:14]1)[c:16]1[n:17][cH:18][c:19]([C:23]#[N:24])[c:20]([CH3:22])[n:21]1

Participants

Reactant 4

HCID 887Methanol

HCID 923Sodium ion

HCID 961Hydroxide

HCID 67083915(5-Cyano-4-methyl-pyrimidin-2-yl)-[3-(1-methyl-piperidin-4-yl)-propyl]-carbamic acid ethyl ester

Product 1

HCID 445457774-Methyl-2-[3-(1-methyl-piperidin-4-yl)-propylamino]-pyrimidine-5-carbonitrile

Sources & evidence

ORD record: ord-929cb65cd8fe436ab25f01aa5aef73f1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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