1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine

Base Information

• Chemical Name: 1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine
• CAS No.: 1013-47-4
• Molecular Formula: C₁₂H₁₆N₂
• Molecular Weight: 188.272
• Hs Code.: 2933990090
• European Community (EC) Number: 897-918-4
• Mol file: 1013-47-4.mol

Synonyms:1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine;1013-47-4;1-(7-methyl-1H-indol-3-yl)propan-2-amine;7-methyl-alpha-methyltryptamine;SCHEMBL10646800;AKOS000301666;AKOS017259202;EN300-359759;1-methyl-2-(7-methyl-1h-indol-3-yl)ethyl amine

Chemical Property of 1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine

Chemical Property:

• PSA: 41.81000
• LogP: 3.06630
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 188.131348519
• Heavy Atom Count: 14
• Complexity: 193

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2C(=CC=C1)C(=CN2)CC(C)N
• Uses: 1-(7-Methyl-1H-indol-3-yl)propan-2-amine is used in the syntesis of alpha-methyltryptamine inhibitors.

Technology Process of 1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine

There total 4 articles about 1-Methyl-2-(7-methyl-1H-indol-3-yl)-ethylamine 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:

7-methyl-3-(2-nitro-propenyl)-1H-indole (91392-37-9) → 1-methyl-2-(7-methyl-indol-3-yl)-ethylamine (1013-47-4)

Guidance literature:

With chloro-trimethyl-silane; borane; In tetrahydrofuran; at 20 ℃; for 14h;

DOI:10.1016/j.bmcl.2006.10.058

Reference yield:

7-methyl-1H-indole-3-carbaldehyde (4771-50-0) → 1-methyl-2-(7-methyl-indol-3-yl)-ethylamine (1013-47-4)

Guidance literature:

Multi-step reaction with 2 steps

1: AcOH / 20 °C / sonication

2: BH₃; TMSCl / tetrahydrofuran / 14 h / 20 °C

With chloro-trimethyl-silane; borane; acetic acid; In tetrahydrofuran;

DOI:10.1016/j.bmcl.2006.10.058

Reference yield:

7-methyl-3-(2-nitro-propenyl)-1H-indole → 1-methyl-2-(7-methyl-indol-3-yl)-ethylamine (1013-47-4)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; diethyl ether; for 5.5h; Heating;

DOI:10.1248/cpb.53.184

upstream raw materials:

7-methyl-3-(2-nitro-propenyl)-1H-indole

7-methyl-1H-indole-3-carbaldehyde

Refernces

• 1、 Harada, Hiroshi,Hirokawa, Yoshimi,Suzuki, Kenji,Hiyama, Yoichi,Oue, Mayumi,Kawashima, Hitoshi,Kato, Hiroshi,Yoshida, Naoyuki,Furutani, Yasuji,Kato, Shiro. "Discovery of a novel and potent human and rat β3-adrenergic receptor agonist, [3-[(2R)-[[(2R)-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl] -1H-indol-7-yloxy]acetic acid". . p. 184 - 198. Retrieved 2007/10/03.