N-methyl-2-pyrrolidone → HCID 58255089, compound

HRID 680349Notes

Reaction equation

HRID 680349 reaction equation
[CH3:51][N:52]1[CH2:53][CH2:54][CH2:55][C:56]1=[O:57].[CH:42]([N:43]([CH2:44][CH3:45])[CH:46]([CH3:47])[CH3:48])([CH3:49])[CH3:50].[Cl:1][c:2]1[c:3]([NH:23][c:24]2[n:25][nH:26][c:27]([CH3:29])[cH:28]2)[n:4][c:5]([NH:8][c:9]2[c:10]([F:22])[cH:11][c:12]([CH:16]3[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[c:13]([CH3:15])[cH:14]2)[n:6][cH:7]1.[Cl:30][CH2:31][CH2:32][CH2:33][C:34](=[O:35])[N:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1>>[Cl:1][c:2]1[c:3]([NH:23][c:24]2[n:25][nH:26][c:27]([CH3:29])[cH:28]2)[n:4][c:5]([NH:8][c:9]2[c:10]([F:22])[cH:11][c:12]([CH:16]3[CH2:17][CH2:18][N:19]([CH2:31][CH2:32][CH2:33][C:34](=[O:35])[N:36]4[CH2:37][CH2:38][O:39][CH2:40][CH2:41]4)[CH2:20][CH2:21]3)[c:13]([CH3:15])[cH:14]2)[n:6][cH:7]1

Participants

5

Reactant 4

HCID 13387N-methyl-2-pyrrolidoneHCID 81531DiisopropylethylamineHCID 24348754-Chloro-1-(morpholin-4-yl)butan-1-oneHCID 446126165-chloro-N2-(2-fluoro-5-methyl-4-(piperidin-4-yl)phenyl)-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine

Product 1

HCID 58255089HCID 58255089, compound

Sources & evidence

ORD record
ord-5ee74249a3384383ac0bf3fb03a8ecec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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