Indole, 5-methoxy-3-(2-(1-pyrrolidinyl)ethyl)-

Base Information

• Chemical Name: Indole, 5-methoxy-3-(2-(1-pyrrolidinyl)ethyl)-
• CAS No.: 3949-14-2
• Molecular Formula: C15H20N2O
• Molecular Weight: 244.37
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID50192626
• Nikkaji Number: J238.909F
• Wikipedia: 5-MeO-pyr-T
• Wikidata: Q4639628
• ChEMBL ID: CHEMBL608537
• Mol file: 3949-14-2.mol

Synonyms:CT 4436;5-Methoxy-3-(2-pyrrolidinoethyl)indole;Methoxy-5-pyrrolidino-2'-ethyl-3-indole;3949-14-2;5-Methoxy-3-[2-(1-pyrrolidinyl)ethyl]-1H-indole;BRN 0479607;CHEMBL608537;INDOLE, 5-METHOXY-3-(2-(1-PYRROLIDINYL)ETHYL)-;Indole, 5-methoxy-3-[2-(1-pyrrolidinyl)ethyl]-;5-MEO-PYR-T;NCIOpen2_005795;SCHEMBL24723815;DTXSID50192626;BDBM50474416;LS-83238;Q4639628;1H-Indole, 5-methoxy-3-[2-(1-pyrrolidinyl)ethyl]-

Chemical Property of Indole, 5-methoxy-3-(2-(1-pyrrolidinyl)ethyl)-

Chemical Property:

• Vapor Pressure: 7.42E-07mmHg at 25°C
• Refractive Index: 1.6280 (estimate)
• Boiling Point: 407.7°C at 760 mmHg
• Flash Point: 200.3°C
• PSA: 28.26000
• Density: 1.139g/cm³
• LogP: 2.75270
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 244.157563266
• Heavy Atom Count: 18
• Complexity: 265

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(C=C1)NC=C2CCN3CCCC3

Technology Process of Indole, 5-methoxy-3-(2-(1-pyrrolidinyl)ethyl)-

There total 4 articles about Indole, 5-methoxy-3-(2-(1-pyrrolidinyl)ethyl)- 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:

5-methoxylindole (1006-94-6) → 1-(5-Methoxy-indol-3-yl)-2-pyrrolidino-ethan (3949-14-2)

Guidance literature:

Multi-step reaction with 3 steps

1: diethyl ether

2: H₂O; CHCl₃

3: LiAlH₄

With lithium aluminium tetrahydride; In diethyl ether; chloroform; water;

DOI:10.1021/jm030826m

Reference yield:

(5-methoxy-1H-indol-3-yl)oxoacetyl chloride (2426-19-9) → 1-(5-Methoxy-indol-3-yl)-2-pyrrolidino-ethan (3949-14-2)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂O; CHCl₃

2: LiAlH₄

With lithium aluminium tetrahydride; In chloroform; water;

DOI:10.1021/jm030826m

Reference yield:

1-(5-methoxy-1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethane-1,2-dione (2426-24-6) → 1-(5-Methoxy-indol-3-yl)-2-pyrrolidino-ethan (3949-14-2)

Guidance literature:

With lithium aluminium tetrahydride;

DOI:10.1021/jm030826m

upstream raw materials:

1-(5-methoxy-1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethane-1,2-dione

5-methoxylindole

(5-methoxy-1H-indol-3-yl)oxoacetyl chloride