Trifluoroacetic acid → N-(4-methylcyclohexyl)-5-(4-morpholin-4-ylphenyl)-4-(pyrrolidin-3-ylmethoxy)pyrimidin-2-amine

HRID 1574920Notes

Reaction equation

HRID 1574920 reaction equation
[CH3:1][CH:2]1[CH2:3][CH2:4][CH:5]([NH:8][c:9]2[n:10][cH:11][c:12](-[c:29]3[cH:30][cH:31][c:32]([N:35]4[CH2:36][CH2:37][O:38][CH2:39][CH2:40]4)[cH:33][cH:34]3)[c:13]([O:15][CH2:16][CH:17]3[CH2:18][N:19]([C:22]([O:23][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[CH2:20][CH2:21]3)[n:14]2)[CH2:6][CH2:7]1.[F:41][C:42]([F:43])([F:44])[C:45]([OH:46])=[O:47]>>[CH3:1][CH:2]1[CH2:3][CH2:4][CH:5]([NH:8][c:9]2[n:10][cH:11][c:12](-[c:29]3[cH:30][cH:31][c:32]([N:35]4[CH2:36][CH2:37][O:38][CH2:39][CH2:40]4)[cH:33][cH:34]3)[c:13]([O:15][CH2:16][CH:17]3[CH2:18][NH:19][CH2:20][CH2:21]3)[n:14]2)[CH2:6][CH2:7]1

Participants

3

Reactant 2

HCID 6422Trifluoroacetic acidHCID 71108048Tert-butyl 3-[[2-[(4-methylcyclohexyl)amino]-5-(4-morpholin-4-ylphenyl)pyrimidin-4-yl]oxymethyl]pyrrolidine-1-carboxylate

Product 1

HCID 71108097N-(4-methylcyclohexyl)-5-(4-morpholin-4-ylphenyl)-4-(pyrrolidin-3-ylmethoxy)pyrimidin-2-amine

Sources & evidence

ORD record
ord-e93d50cd21a045ebbaef985cbae5abf3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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