N-(2-methoxyphenyl)nicotinamide

Base Information

• Chemical Name: N-(2-methoxyphenyl)nicotinamide
• CAS No.: 70301-27-8
• Molecular Formula: C13H12N2O2
• Molecular Weight: 228.25
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID20354931
• Wikidata: Q72517935
• ChEMBL ID: CHEMBL1415652
• Mol file: 70301-27-8.mol

Synonyms:N-(2-methoxyphenyl)nicotinamide;70301-27-8;N-(2-methoxyphenyl)pyridine-3-carboxamide;N-(2-Methoxy-phenyl)-nicotinamide;CBMicro_049002;Oprea1_848062;MLS000528940;N-nicotinoyl-2-methoxyaniline;SCHEMBL4651272;CHEMBL1415652;DTXSID20354931;JTYKITZXNYVOSY-UHFFFAOYSA-N;HMS2342D13;AMY10569;STK043098;AKOS000673493;SMR000121415;N-(2-Methoxyphenyl)-3-pyridinecarboxamide;3-Pyridinecarboxamide,N-(2-methoxyphenyl)-;CS-0317298;FT-0729686;L10164;A846537;AE-848/32590004;Z27797402

Chemical Property of N-(2-methoxyphenyl)nicotinamide

Chemical Property:

• Boiling Point: 305℃
• PKA: 11.65±0.70(Predicted)
• Flash Point: 139℃
• PSA: 54.71000
• Density: 1.230
• LogP: 2.72650
• Storage Temp.: 2-8°C
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 228.089877630
• Heavy Atom Count: 17
• Complexity: 258

Purity/Quality:

97% ^*data from raw suppliers

N-(2-Methoxyphenyl)nicotinamide 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC=C1NC(=O)C2=CN=CC=C2

Technology Process of N-(2-methoxyphenyl)nicotinamide

There total 7 articles about N-(2-methoxyphenyl)nicotinamide 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: 75.0%

→ N-(2-methoxyphenyl)nicotinamide (70301-27-8)

Guidance literature:

Reference yield: 40.0%

4-iodoanisol (529-28-2) + nicotinamide (98-92-0,1255150-40-3) → N-(2-methoxyphenyl)nicotinamide (70301-27-8)

Guidance literature:

With iron(III) chloride; potassium carbonate; N,N`-dimethylethylenediamine; In toluene; at 135 ℃; for 24h; Inert atmosphere;

DOI:10.1002/chem.200800293

Reference yield: 38.0%

2-bromoanisole (578-57-4) + nicotinamide (98-92-0,1255150-40-3) → N-(2-methoxyphenyl)nicotinamide (70301-27-8)

Guidance literature:

With dichlorobis(tri-O-tolylphosphine)palladium; caesium carbonate; 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; at 150 ℃; for 72h; Inert atmosphere;

DOI:10.1016/j.tet.2009.01.033

upstream raw materials:

nicotinic acid

2-methoxy-phenylamine

Pyridine-2,3-dicarboxylic anhydride

3-pyridinecarbonyl chloride