1-Ethylpiperazine → 4-(2-aminopyrimidin-5-yl)-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidine-7-carboxamide

HRID 2140707Notes

Reaction equation

HRID 2140707 reaction equation
[CH2:41]([N:42]1[CH2:43][CH2:44][N:45]([c:46]2[cH:47][cH:48][c:49]([NH2:50])[c:51]([CH3:52])[cH:53]2)[CH2:54][CH2:55]1)[CH3:56].[CH2:57]([N:58]1[CH2:59][CH2:60][NH:61][CH2:62][CH2:63]1)[CH3:64].[CH2:79]([CH3:80])[N:81]1[CH2:82][CH2:83][N:84]([c:87]2[cH:88][c:89]([CH3:136])[c:90]([NH:93][C:94](=[O:95])[N:96]3[CH2:97][CH2:98][c:99]4[c:100]3[n:101][c:102]([N:130]3[CH2:131][CH2:132][O:133][CH2:134][CH2:135]3)[n:103][c:104]4-[c:105]3[cH:106][n:107][c:108]([N:111]([CH2:112][c:113]4[cH:114][cH:115][c:116]([O:117][CH3:118])[cH:119][cH:120]4)[CH2:121][c:122]4[cH:123][cH:124][c:125]([O:126][CH3:127])[cH:128][cH:129]4)[n:109][cH:110]3)[cH:91][cH:92]2)[CH2:85][CH2:86]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([CH2:9][c:10]2[cH:11][cH:12][c:13]([O:14][CH3:15])[cH:16][cH:17]2)[c:18]2[n:19][cH:20][c:21](-[c:22]3[c:23]4[c:27]([n:28][c:29]([N:30]5[CH2:31][CH2:32][O:33][CH2:34][CH2:35]5)[n:36]3)[NH:26][CH2:25][CH2:24]4)[cH:37][n:38]2)[cH:39][cH:40]1.[CH3:65][c:66]1[cH:67][cH:68][c:69]([N:70]2[CH2:71][CH2:72][O:73][CH2:74][CH2:75]2)[cH:76][c:77]1[NH2:78]>>[CH2:79]([CH3:80])[N:81]1[CH2:82][CH2:83][N:84]([c:87]2[cH:88][c:89]([CH3:136])[c:90]([NH:93][C:94](=[O:95])[N:96]3[CH2:97][CH2:98][c:99]4[c:100]3[n:101][c:102]([N:130]3[CH2:131][CH2:132][O:133][CH2:134][CH2:135]3)[n:103][c:104]4-[c:105]3[cH:106][n:107][c:108]([NH2:111])[n:109][cH:110]3)[cH:91][cH:92]2)[CH2:85][CH2:86]1

Participants

6

Reactant 5

HCID 791961-EthylpiperazineHCID 21253244-(4-Ethylpiperazin-1-yl)-2-methylanilineHCID 392386232-Methyl-5-morpholinoanilineHCID 45258862Bis-(4-methoxybenzyl)-[5-(2-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)-pyrimidin-2-yl]-amineHCID 866401364-{2-[Bis-(4-methoxy-benzyl)-amino]-pyrimidin-5-yl}-2-morpholin-4-yl-5,6-dihydro-pyrrolo[2,3-d]pyrimidine-7-carboxylic acid [4-(4-ethyl-piperazin-1-yl)-2-methyl-phenyl]-amide

Product 1

HCID 592444084-(2-aminopyrimidin-5-yl)-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidine-7-carboxamide

Sources & evidence

ORD record
ord-32b8568ce6194fe19c55e3f337d544aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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