Methanol → 4-amino-3-fluoro-N-(1-methyl-4-piperidyl)benzamide

HRID 1226712Notes

Reaction equation

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

Participants

Reactant 7

HCID 887Methanol

HCID 6228Dimethylformamide

HCID 9886Hexafluorophosphate

HCID 99714-Amino-3-fluorobenzoic acid

HCID 81531Diisopropylethylamine

HCID 27375314-Amino-1-methylpiperidine

HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 626798464-amino-3-fluoro-N-(1-methyl-4-piperidyl)benzamide

Sources & evidence

ORD record: ord-1605f042c9bf4c819cd435d39335c485
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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