1-[(1-Methylpiperidin-2-yl)methyl]-1H-indole

Base Information

• Chemical Name: 1-[(1-Methylpiperidin-2-yl)methyl]-1H-indole
• CAS No.: 137641-68-0
• Molecular Formula: C15H20N2
• Molecular Weight: 228.337
• DSSTox Substance ID: DTXSID60468420
• Mol file: 137641-68-0.mol

Synonyms:137641-68-0;N-(N-Methylpiperidinyl)methylindole;1-[(1-Methylpiperidin-2-yl)methyl]-1H-indole;1-((1-Methylpiperidin-2-yl)methyl)-1H-indole;1-[(1-METHYLPIPERIDIN-2-YL)METHYL]INDOLE;1h-indole,1-[(1-methyl-2-piperidinyl)methyl]-;SCHEMBL2911126;DTXSID60468420;XVOUFWJFSTTZOA-UHFFFAOYSA-N;AMY32190;AKOS027447122;SS-5216;(N-Methyl-2-piperidinyl)methyl-1H-indole

Chemical Property of 1-[(1-Methylpiperidin-2-yl)methyl]-1H-indole

Chemical Property:

• PSA: 8.17000
• LogP: 3.06350
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 228.162648646
• Heavy Atom Count: 17
• Complexity: 253

Purity/Quality:

N-(N-Methylpiperidinyl)methylindole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCCCC1CN2C=CC3=CC=CC=C32
• Uses: 1-((1-Methylpiperidin-2-yl)Methyl)-1H-indole is used in the preparation of CB1 cannabinoid receptor agonists and brain imaging agents.

Technology Process of 1-[(1-Methylpiperidin-2-yl)methyl]-1H-indole

There total 1 articles about 1-[(1-Methylpiperidin-2-yl)methyl]-1H-indole 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:

indole (120-72-9) + 2-(chloromethyl)-N-methyl-piperidine (49665-74-9) → 1-(1-methylpiperidin-2-ylmethyl)-1H-indole (137641-68-0) + 1-[(1-methyl-3-piperidinyl)methyl]-5-fluoro-1H-indole

Guidance literature:

With potassium hydroxide; In dimethyl sulfoxide;

Reference yield: 93.0%

1-(1-methylpiperidin-2-ylmethyl)-1H-indole (137641-68-0) + 2-Iodobenzoyl chloride (609-67-6) → (2-iodophenyl)[1-[(1-methyl-2-piperidinyl)methyl]-1H-indol-3-yl]methanone (444912-75-8)

Guidance literature:

With aluminium trichloride; In dichloromethane; at 40 ℃;

DOI:10.1021/jm050135l

Reference yield:

1-(1-methylpiperidin-2-ylmethyl)-1H-indole (137641-68-0) → (2-iodo-phenyl)-[1-(1-methyl-piperidin-2-ylmethyl)-1H-indol-3-yl]-methanone (444912-57-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 93 percent / AlCl₃ / CH₂Cl₂ / 40 °C

2: chiral HPLC

With aluminium trichloride; In dichloromethane;

DOI:10.1021/jm050135l

upstream raw materials:

indole

2-(chloromethyl)-N-methyl-piperidine

Downstream raw materials:

3-(6-benzyloxy-1-naphthoyl)-1-(N-methylpiperidin-2-ylmethyl)indole

3-(4-benzyloxy-1-naphthoyl)-1-(N-methylpiperidin-2-ylmethyl)indole

(2-iodophenyl)[1-[(1-methyl-2-piperidinyl)methyl]-1H-indol-3-yl]methanone

[1-[(1-methyl-2-piperidinyl)methyl]-1H-indol-3-yl]-1-naphthalenylmethanone

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