Dichloromethane → 1-(3,3-Dimethyl-butyl)-piperidine-4-carboxylic Acid 2-methyl-4-[methyl-(4-trifluoromethyl-phenyl)-carbamoyl]-benzylamide

HRID 1562494Notes

Reaction equation

HRID 1562494 reaction equation
[CH3:1][C:2]([CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][CH:8]([C:11](=[O:12])[OH:13])[CH2:9][CH2:10]1)([CH3:14])[CH3:15].[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[Cl:48][CH2:49][Cl:50].[NH2:16][CH2:17][c:18]1[c:19]([CH3:38])[cH:20][c:21]([C:22](=[O:23])[N:24]([c:25]2[cH:26][cH:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]2)[CH3:35])[cH:36][cH:37]1>>[CH3:1][C:2]([CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][CH:8]([C:11](=[O:13])[NH:16][CH2:17][c:18]2[c:19]([CH3:38])[cH:20][c:21]([C:22](=[O:23])[N:24]([c:25]3[cH:26][cH:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)[CH3:35])[cH:36][cH:37]2)[CH2:9][CH2:10]1)([CH3:14])[CH3:15]

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 231123781-(3,3-Dimethylbutyl)piperidine-4-carboxylic acidHCID 575553064-Aminomethyl-3,N-dimethyl-N-(4-trifluoromethyl-phenyl)-benzamide

Product 1

HCID 575554091-(3,3-Dimethyl-butyl)-piperidine-4-carboxylic Acid 2-methyl-4-[methyl-(4-trifluoromethyl-phenyl)-carbamoyl]-benzylamide

Sources & evidence

ORD record
ord-43cd13ae442f45c4a1c073fd5122a83d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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