3-Methyl-5-(trifluoromethyl)benzoic acid → N-[1-(1-acetylpiperidine-4-carbonyl)-3-(3,4-dichlorophenyl)piperidin-4-yl]-N,3-dimethyl-5-(trifluoromethyl)benzamide

HRID 1136088Notes

Reaction equation

HRID 1136088 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][CH:7]([C:10](=[O:11])[N:12]2[CH2:13][CH:14]([c:20]3[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]3)[CH:15]([NH:18][CH3:19])[CH2:16][CH2:17]2)[CH2:8][CH2:9]1.[CH3:28][c:29]1[cH:30][c:31]([C:32](=[O:33])[OH:34])[cH:35][c:36]([C:38]([F:39])([F:40])[F:41])[cH:37]1>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][CH:7]([C:10](=[O:11])[N:12]2[CH2:13][CH:14]([c:20]3[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]3)[CH:15]([N:18]([CH3:19])[C:32]([c:31]3[cH:30][c:29]([CH3:28])[cH:37][c:36]([C:38]([F:39])([F:40])[F:41])[cH:35]3)=[O:34])[CH2:16][CH2:17]2)[CH2:8][CH2:9]1

Participants

3

Reactant 2

HCID 27755883-Methyl-5-(trifluoromethyl)benzoic acidHCID 689300921-[4-[3-(3,4-Dichlorophenyl)-4-(methylamino)piperidine-1-carbonyl]piperidin-1-yl]ethanone

Product 1

HCID 77574281N-[1-(1-acetylpiperidine-4-carbonyl)-3-(3,4-dichlorophenyl)piperidin-4-yl]-N,3-dimethyl-5-(trifluoromethyl)benzamide

Sources & evidence

ORD record
ord-fbdbf594e9874b1a9ef6a56b79b8e12e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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