1-Butanol → N-(2-Amino-5,6,7,8-tetrahydroquinazoline-4-yl)-N-(cyclohexylmethyl)amine

Reaction equation

[CH2:28]([OH:29])[CH2:30][CH2:31][CH3:32].[CH3:13][CH2:14][N:15]([CH2:16][CH3:17])[CH2:18][CH3:19].[CH:20]1([CH2:26][NH2:27])[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]1.[Cl:1][c:2]1[n:3][c:4]([NH2:12])[n:5][c:6]2[c:11]1[CH2:10][CH2:9][CH2:8][CH2:7]2>>[c:2]1([NH:27][CH2:26][CH:20]2[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]2)[n:3][c:4]([NH2:12])[n:5][c:6]2[c:11]1[CH2:10][CH2:9][CH2:8][CH2:7]2

Participants

Reactant 4

HCID 2631-Butanol

HCID 8471Triethylamine

HCID 76688Cyclohexanemethylamine

HCID 137078204-Chloro-5,6,7,8-tetrahydroquinazolin-2-amine

Product 1

HCID 15896203N-(2-Amino-5,6,7,8-tetrahydroquinazoline-4-yl)-N-(cyclohexylmethyl)amine

Sources & evidence

ORD record: ord-585ff6c09d9247949ffe06bf3c27df39
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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