Water → Piperazine, 1-cyclopentyl-4-(4-nitro-2-pyridinyl)-

HRID 2312744Notes

Reaction equation

HRID 2312744 reaction equation
[CH:11]1([N:16]2[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]2)[CH2:12][CH2:13][CH2:14][CH2:15]1.[CH:22]([N:23]([CH2:24][CH3:25])[CH:26]([CH3:27])[CH3:28])([CH3:29])[CH3:30].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([N+:8](=[O:9])[O-:10])[cH:7]1.[O:31]=[CH:32][N:33]([CH3:34])[CH3:35].[OH2:36]>>[c:2]1([N:19]2[CH2:18][CH2:17][N:16]([CH:11]3[CH2:12][CH2:13][CH2:14][CH2:15]3)[CH2:21][CH2:20]2)[n:3][cH:4][cH:5][c:6]([N+:8](=[O:9])[O-:10])[cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 7351522-Chloro-4-nitropyridineHCID 8064211-Cyclopentylpiperazine

Product 1

HCID 51105608Piperazine, 1-cyclopentyl-4-(4-nitro-2-pyridinyl)-

Sources & evidence

ORD record
ord-4ba3e98923ea4d879e9c336cb6d32109
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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