Dimethylformamide → 2-Fluoro-N-(1-methyl-4-piperidinyl)-4-nitrobenzamide

HRID 700117Notes

Reaction equation

HRID 700117 reaction equation
[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[F:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][cH:8][c:9]([N+:11](=[O:12])[O-:13])[cH:10]1.[NH2:14][CH:15]1[CH2:16][CH2:17][N:18]([CH3:21])[CH2:19][CH2:20]1.[O:55]=[CH:56][N:57]([CH3:58])[CH3:59].[P-:22]([F:23])([F:24])([F:25])([F:26])([F:27])[F:28].[n:29]1([O:30][C:31]([N:32]([CH3:33])[CH3:34])=[N+:35]([CH3:36])[CH3:37])[c:38]2[n:39][cH:40][cH:41][cH:42][c:43]2[n:44][n:45]1>>[F:1][c:2]1[c:3]([C:4](=[O:6])[NH:14][CH:15]2[CH2:16][CH2:17][N:18]([CH3:21])[CH2:19][CH2:20]2)[cH:7][cH:8][c:9]([N+:11](=[O:12])[O-:13])[cH:10]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 3026792-Fluoro-4-nitrobenzoic acidHCID 27375314-Amino-1-methylpiperidineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 580097692-Fluoro-N-(1-methyl-4-piperidinyl)-4-nitrobenzamide

Sources & evidence

ORD record
ord-b2e42c8d7b2e4fd8ac143c0a26154167
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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