2-[4-(4-Methoxyphenyl)piperazin-1-yl]ethanamine

Base Information

• Chemical Name: 2-[4-(4-Methoxyphenyl)piperazin-1-yl]ethanamine
• CAS No.: 20529-26-4
• Molecular Formula: C13H21N3O
• Molecular Weight: 235.329
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID30361393
• Wikidata: Q82143718
• Mol file: 20529-26-4.mol

Synonyms:2-[4-(4-methoxyphenyl)piperazin-1-yl]ethanamine;20529-26-4;2-[4-(4-METHOXYPHENYL)PIPERAZIN-1-YL]ETHAN-1-AMINE;MLS004820165;F2158-0050;SCHEMBL4251574;DTXSID30361393;HMS1601I01;MFCD03030390;STK504320;AKOS000154299;AB13011;LS-02606;SMR001534429;4-(4-methoxyphenyl)piperazin-1-ylethylamine;CS-0216747;FT-0709543;EN300-57326;VU0490372-1;2-(4-(4-methoxyphenyl)piperazin-1-yl)ethylamine;SR-01000297628;SR-01000297628-1;2-[4-(4-Methoxy-phenyl)-piperazin-1-yl]-ethylamine

Chemical Property of 2-[4-(4-Methoxyphenyl)piperazin-1-yl]ethanamine

Chemical Property:

• PSA: 41.73000
• LogP: 1.47910
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 235.168462302
• Heavy Atom Count: 17
• Complexity: 209

Purity/Quality:

98%min ^*data from raw suppliers

2-[4-(4-Methoxyphenyl)-1-piperazinyl]ethanamine AldrichCPR ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)N2CCN(CC2)CCN

Technology Process of 2-[4-(4-Methoxyphenyl)piperazin-1-yl]ethanamine

There total 5 articles about 2-[4-(4-Methoxyphenyl)piperazin-1-yl]ethanamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

2-(2-(4-(4-methoxyphenyl)piperazin-1-yl)ethyl)isoindoline-1,3-dione (117046-73-8) → 2-[4-(4-methoxy-phenyl)-piperazin-1-yl]-ethylamine (20529-26-4)

Guidance literature:

With hydrazine; In ethanol; at 70 ℃; for 5h;

DOI:10.1016/j.bmc.2004.06.011

Reference yield:

1-(cyanomethyl)-4-(4-methoxyphenyl)-piperazine → 2-[4-(4-methoxy-phenyl)-piperazin-1-yl]-ethylamine (20529-26-4)

Guidance literature:

With sodium hydroxide; ammonia; In tetrahydrofuran; methanol; dichloromethane; water;

Reference yield:

4-(4-methoxyphenyl)piperazine (38212-30-5) → 2-[4-(4-methoxy-phenyl)-piperazin-1-yl]-ethylamine (20529-26-4)

Guidance literature:

Multi-step reaction with 2 steps

1: Et₃N / acetonitrile / 100 °C

2: hydrazine hydrate / ethanol / 80 °C

With hydrazine hydrate; triethylamine; In ethanol; acetonitrile;

DOI:10.1016/j.bmcl.2005.05.003

upstream raw materials:

2-(2-(4-(4-methoxyphenyl)piperazin-1-yl)ethyl)isoindoline-1,3-dione

4-(4-methoxyphenyl)piperazine

Downstream raw materials:

1-(2-[2-quinolyl]amino)-ethyl-4-(4-methoxyphenyl) piperazine.hydrochloride

2-(furan-2-yl)-N⁵-(2-(4-(4-methoxyphenyl)piperazin-1-yl)ethyl)-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine

C₂₆H₃₄N₄O₂*ClH

N-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-2-quinoxaline carboxamide

Refernces

• 1、 Graulich, Amaury,Lonard, Marc,Rsimont, Mlissa,Huang, Xi-Ping,Roth, Bryan L.,Ligeois, Jean-Franois. "Chemical modifications on 4-arylpiperazine-ethyl carboxamide derivatives differentially modulate affinity for 5-HT1A, D4.2, and α2A receptors: Synthesis and in vitro radioligand binding studies". experimental part. p. 56 - 67. Retrieved 2010/05/18.
• 2、 Li, Min-Yong,Fang, Hao,Xia, Lin. "Pharmacophore-based design, synthesis, biological evaluation, and 3D-QSAR studies of aryl-piperazines as α1-adrenoceptor antagonists". . p. 3216 - 3219. Retrieved 2007/10/03.