Hydrochloric Acid → (3-Amino-1-propan-2-ylcyclopentyl)-[4-[4-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methanone

HRID 2129973Notes

Reaction equation

HRID 2129973 reaction equation
[CH2:36]1[O:37][CH2:38][CH2:39][O:40][CH2:41]1.[CH:1]([CH3:2])([CH3:3])[C:4]1([C:17](=[O:18])[N:19]2[CH2:20][CH2:21][N:22]([c:25]3[n:26][cH:27][cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]3)[CH2:23][CH2:24]2)[CH2:5][CH:6]([NH:9][C:10](=[O:11])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[CH2:7][CH2:8]1.[ClH:35]>>[CH:1]([CH3:2])([CH3:3])[C:4]1([C:17](=[O:18])[N:19]2[CH2:20][CH2:21][N:22]([c:25]3[n:26][cH:27][cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]3)[CH2:23][CH2:24]2)[CH2:5][CH:6]([NH2:9])[CH2:7][CH2:8]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 72573887tert-butyl N-[3-propan-2-yl-3-[4-[4-(trifluoromethyl)-2-pyridinyl]piperazine-1-carbonyl]cyclopentyl]carbamate

Product 1

HCID 76652790(3-Amino-1-propan-2-ylcyclopentyl)-[4-[4-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methanone

Sources & evidence

ORD record
ord-26e244f020c44eb980860e824ee6a3cc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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