1-Pyrrolidineethanamine → 5-methyl-N-(2-(pyrrolidin-1-yl)ethyl)-4-(2-(tetrahydro-2H-pyran-4-yloxy)pyridin-3-ylamino)thieno[2,3-d]pyrimidine-6-carboxamide

HRID 180903Notes

Reaction equation

HRID 180903 reaction equation
[CH3:25][c:26]1[c:27]([C:49](=[O:50])[OH:51])[s:28][c:29]2[n:30][cH:31][n:32][c:33]([NH:35][c:36]3[c:37]([O:42][CH:43]4[CH2:44][CH2:45][O:46][CH2:47][CH2:48]4)[n:38][cH:39][cH:40][cH:41]3)[c:34]12.[CH:52]([N:53]([CH2:54][CH3:55])[CH:56]([CH3:57])[CH3:58])([CH3:59])[CH3:60].[NH2:61][CH2:62][CH2:63][N:64]1[CH2:65][CH2:66][CH2:67][CH2:68]1.[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[CH3:25][c:26]1[c:27]([C:49](=[O:50])[NH:61][CH2:62][CH2:63][N:64]2[CH2:65][CH2:66][CH2:67][CH2:68]2)[s:28][c:29]2[n:30][cH:31][n:32][c:33]([NH:35][c:36]3[c:37]([O:42][CH:43]4[CH2:44][CH2:45][O:46][CH2:47][CH2:48]4)[n:38][cH:39][cH:40][cH:41]3)[c:34]12

Participants

7

Reactant 6

HCID 13441-PyrrolidineethanamineHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 584131025-methyl-4-(2-(tetrahydro-2H-pyran-4-yloxy)pyridin-3-ylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid

Product 1

HCID 461821285-methyl-N-(2-(pyrrolidin-1-yl)ethyl)-4-(2-(tetrahydro-2H-pyran-4-yloxy)pyridin-3-ylamino)thieno[2,3-d]pyrimidine-6-carboxamide

Sources & evidence

ORD record
ord-5390310eaf6c4c448d3961ef552a7e92
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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