2-((6-(3-Amino-1-piperidinyl)-3,4-dihydro-3-methyl-2,4-dioxo-1(2H)-pyrimidinyl)methyl)benzonitrile → Alogliptin Impurity 13

Reaction equation

[Cl:1][c:2]1[n:3]([CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[C:11]#[N:12])[c:13](=[O:14])[nH:15][c:16](=[O:17])[cH:18]1.[NH2:19][CH:20]1[CH2:21][N:22]([c:26]2[cH:27][c:28](=[O:43])[n:29]([CH3:42])[c:30](=[O:41])[n:31]2[CH2:32][c:33]2[c:34]([C:35]#[N:36])[cH:37][cH:38][cH:39][cH:40]2)[CH2:23][CH2:24][CH2:25]1>>[NH2:19][CH:20]1[CH2:21][N:22]([c:26]2[cH:27][c:28](=[O:43])[nH:29][c:30](=[O:41])[n:31]2[CH2:32][c:33]2[c:34]([C:35]#[N:36])[cH:37][cH:38][cH:39][cH:40]2)[CH2:23][CH2:24][CH2:25]1

Participants

Reactant 2

HCID 111635842-((6-(3-Amino-1-piperidinyl)-3,4-dihydro-3-methyl-2,4-dioxo-1(2H)-pyrimidinyl)methyl)benzonitrile

HCID 113574682-((6-Chloro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)methyl)benzonitrile

Product 1

HCID 11738869Alogliptin Impurity 13

Sources & evidence

ORD record: ord-84f65b6ea935440fae97504ef3923c5c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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