N-(4-nitrophenyl)pyridine-2-carboxamide

Base Information

• Chemical Name: N-(4-nitrophenyl)pyridine-2-carboxamide
• CAS No.: 61349-99-3
• Molecular Formula: C12H9N3O3
• Molecular Weight: 243.222
• DSSTox Substance ID: DTXSID50572540
• Wikidata: Q82460920
• Mol file: 61349-99-3.mol

Synonyms:N-(4-nitrophenyl)pyridine-2-carboxamide;61349-99-3;2-Pyridinecarboxamide, N-(4-nitrophenyl)-;SCHEMBL16592576;DTXSID50572540;AKOS003020234

Chemical Property of N-(4-nitrophenyl)pyridine-2-carboxamide

Chemical Property:

• PSA: 87.81000
• LogP: 2.83830
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 243.06439116
• Heavy Atom Count: 18
• Complexity: 308

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Technology Process of N-(4-nitrophenyl)pyridine-2-carboxamide

There total 9 articles about N-(4-nitrophenyl)pyridine-2-carboxamide 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: 94.0%

→ pyridine-2-carboxylic acid (4-nitro-phenyl)amide (61349-99-3)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; HATU; In ethyl acetate; at 45 ℃; for 19h;

Reference yield: 90.0%

2-Picolinic acid (98-98-6) + 4-nitro-aniline (100-01-6,104810-17-5) → pyridine-2-carboxylic acid (4-nitro-phenyl)amide (61349-99-3)

Guidance literature:

2-Picolinic acid; 4-nitro-aniline; In pyridine; at 39.84 ℃; for 0.333333h;

With triphenyl phosphite; In pyridine; at 19.84 - 99.84 ℃; for 29h;

DOI:10.1016/j.catcom.2015.02.023

Reference yield: 83.0%

pyridine (110-86-1) + p-nitrophenyl isocyanide (1984-23-2) → 2-[1-(4-nitro-phenyl)-1H-tetrazol-5-yl]-pyridine + tetrazolo[1,5-a]pyridine (274-87-3) + pyridine-2-carboxylic acid (4-nitro-phenyl)amide (61349-99-3)

Guidance literature:

pyridine; With fluorine; In chloroform; at -78 - -60 ℃;

p-nitrophenyl isocyanide; With trimethylsilylazide; In chloroform; at -50 - 0 ℃;

DOI:10.1016/j.tetlet.2005.05.066

upstream raw materials:

2-Picolinic acid

4-nitro-aniline

sodium benzoate

N-(4-Nitro-phenyl)-pyridine-2-carboximidoyl chloride; hydrochloride

Downstream raw materials:

Ir(2-phenylpyridine)2(C₅H₄NCONC₆H₄NO₂)

(CH₃)Al(C₅H₄N(CO)NC₆H₄NO₂)2

4-nitro-2-trifluoromethyl-aniline

N-(4-((3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino)phenyl)picolinamide