N-[2-(3-methoxyphenyl)ethyl]propanamide

Base Information

• Chemical Name: N-[2-(3-methoxyphenyl)ethyl]propanamide
• CAS No.: 112649-80-6
• Molecular Formula: C12H17NO2
• Molecular Weight: 207.272
• DSSTox Substance ID: DTXSID60442083
• Nikkaji Number: J746.125I
• ChEMBL ID: CHEMBL53925
• Mol file: 112649-80-6.mol

Synonyms:CHEMBL53925;N-[2-(3-methoxyphenyl)ethyl]propanamide;112649-80-6;SCHEMBL12964151;DTXSID60442083;BDBM50471033;N-[2-(3-Methoxyphenyl)ethyl]propionamide

Chemical Property of N-[2-(3-methoxyphenyl)ethyl]propanamide

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 207.125928785
• Heavy Atom Count: 15
• Complexity: 194

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=O)NCCC1=CC(=CC=C1)OC

Technology Process of N-[2-(3-methoxyphenyl)ethyl]propanamide

There total 4 articles about N-[2-(3-methoxyphenyl)ethyl]propanamide 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: 73.0%

propionyl chloride (79-03-8) + 2-(3-methoxyphenyl)-1-ethanamine (2039-67-0) → N-[2-(3-Methoxyphenyl)ethyl]propanamide (112649-80-6)

Guidance literature:

With pyridine; for 2h; Ambient temperature;

DOI:10.1002/ardp.19873200905

Reference yield: 69.0%

propionic acid anhydride (123-62-6) + 2-(3-methoxyphenyl)-1-ethanamine (2039-67-0) → N-[2-(3-Methoxyphenyl)ethyl]propanamide (112649-80-6)

Guidance literature:

With triethylamine; In dichloromethane; for 2h; Ambient temperature;

Reference yield:

(E)-1-methoxy-3-(2-nitrovinyl)benzene (3179-09-7,55446-68-9) → N-[2-(3-Methoxyphenyl)ethyl]propanamide (112649-80-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 75 percent / LiAlH₄ / diethyl ether / 1.5 h / Heating

2: 73 percent / pyridine / 2 h / Ambient temperature

With pyridine; lithium aluminium tetrahydride; In diethyl ether;

DOI:10.1002/ardp.19873200905

upstream raw materials:

propionyl chloride

2-(3-methoxyphenyl)-1-ethanamine

propionic acid anhydride

(E)-1-methoxy-3-(2-nitrovinyl)benzene

Downstream raw materials:

2-(2-bromo-5-methoxybenzoyl)-1-ethylidene-1,2,3,4-tetrahydro-6-methoxyisoquinoline

(Z)-1-Ethylidene-1,2,3,4-tetrahydro-6-methoxy-2-(3-methoxybenzoyl)isoquinoline