Hydrochloric Acid → 2-(4-cyclopropylphenyl)-N-[2-hydroxy-1-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]ethyl]acetamide

HRID 125611Notes

Reaction equation

HRID 125611 reaction equation
[CH3:33][N:34]([CH3:35])[CH2:36][CH2:37][CH2:38][N:39]=[C:40]=[N:41][CH2:42][CH3:43].[CH3:54][CH2:55][N:56]([CH2:57][CH3:58])[CH2:59][CH3:60].[CH3:61][N:62]([CH3:63])[CH:64]=[O:65].[CH:1]1([c:4]2[cH:5][cH:6][c:7]([CH2:10][C:11](=[O:12])[OH:13])[cH:8][cH:9]2)[CH2:2][CH2:3]1.[ClH:14].[ClH:15].[ClH:32].[NH2:16][CH:17]([CH2:18][OH:19])[c:20]1[n:21][cH:22][c:23]([O:26][CH2:27][C:28]([F:29])([F:30])[F:31])[cH:24][cH:25]1.[OH:44][n:45]1[c:46]2[n:47][cH:48][cH:49][cH:50][c:51]2[n:52][n:53]1>>[CH:1]1([c:4]2[cH:5][cH:6][c:7]([CH2:10][C:11](=[O:13])[NH:16][CH:17]([CH2:18][OH:19])[c:20]3[n:21][cH:22][c:23]([O:26][CH2:27][C:28]([F:29])([F:30])[F:31])[cH:24][cH:25]3)[cH:8][cH:9]2)[CH2:2][CH2:3]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid3×HCID 6228DimethylformamideHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 181649HOAtHCID 204905282-(4-Cyclopropylphenyl)acetic acidHCID 771643142-Amino-2-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]ethanol

Product 1

HCID 766553862-(4-cyclopropylphenyl)-N-[2-hydroxy-1-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]ethyl]acetamide

Sources & evidence

ORD record
ord-1faedf3e3fd340849edf46e41be6fd51
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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