Acetic Acid → Methyl 1-[2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]-4-[(1-phenylethylamino)methyl]phenyl]piperidine-4-carboxylate

HRID 119858Notes

Reaction equation

HRID 119858 reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[CH3:41][CH2:42][O:43][C:44]([CH3:45])=[O:46].[CH:1](=[O:2])[c:3]1[cH:4][c:5]([NH:19][C:20](=[O:21])[c:22]2[n:23][o:24][c:25]([CH3:27])[cH:26]2)[c:6]([N:9]2[CH2:10][CH2:11][CH:12]([C:15](=[O:16])[O:17][CH3:18])[CH2:13][CH2:14]2)[cH:7][cH:8]1.[c:32]1([CH:38]([CH3:39])[NH2:40])[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[CH2:1]([c:3]1[cH:4][c:5]([NH:19][C:20](=[O:21])[c:22]2[n:23][o:24][c:25]([CH3:27])[cH:26]2)[c:6]([N:9]2[CH2:10][CH2:11][CH:12]([C:15](=[O:16])[O:17][CH3:18])[CH2:13][CH2:14]2)[cH:7][cH:8]1)[NH:40][CH:38]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[CH3:39]

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 74081-PhenethylamineHCID 8857Ethyl AcetateHCID 59803206Methyl 1-(4-formyl-2-(5-methylisoxazole-3-carboxamido)phenyl)piperidine-4-carboxylate

Product 1

HCID 69274577Methyl 1-[2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]-4-[(1-phenylethylamino)methyl]phenyl]piperidine-4-carboxylate

Sources & evidence

ORD record
ord-3fed55cdd1fd4bc1a30129c4a8639000
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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