(6-broMopyridin-2-yl)(1-Methylpiperidin-4-yl)Methanone

Base Information

• Chemical Name: (6-broMopyridin-2-yl)(1-Methylpiperidin-4-yl)Methanone
• CAS No.: 613678-08-3
• Molecular Formula: C12H15BrN2O
• Molecular Weight: 283.168
• DSSTox Substance ID: DTXSID90591896
• Wikidata: Q82485763
• Mol file: 613678-08-3.mol

Synonyms:6-brmMlopyridin-2-yl)(1-Metlylpiperidin-4-ylMethanome;(6-Bromo-2-pyridinyl)(1-methyl-4-piperidinyl)methanone;(6-broMopyridin-2-yl)(1-Methylpiperidin-4-yl)Methanone;Methanone, (6-bromo-2-pyridinyl)(1-methyl-4-piperidinyl)-;(6-Bromo-2-pyridinyl)(1-methyl-4-piperidinyl)methanone(For export only)

Chemical Property of (6-broMopyridin-2-yl)(1-Methylpiperidin-4-yl)Methanone

Chemical Property:

• Boiling Point: 370.5±42.0 °C(Predicted)
• PKA: 8.07±0.10(Predicted)
• PSA: 33.20000
• Density: 1.388±0.06 g/cm3(Predicted)
• LogP: 2.30650
• Storage Temp.: 2-8°C
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 282.03678
• Heavy Atom Count: 16
• Complexity: 251

Purity/Quality:

98%Min ^*data from raw suppliers

(6-Bromopyridin-2-yl)(1-methylpiperidin-4-yl)methanone 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1CCC(CC1)C(=O)C2=NC(=CC=C2)Br

Technology Process of (6-broMopyridin-2-yl)(1-Methylpiperidin-4-yl)Methanone

There total 4 articles about (6-broMopyridin-2-yl)(1-Methylpiperidin-4-yl)Methanone 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: 96.0%

N,N,1-trimethylpiperidine-4-carboxamide (613678-09-4) → (6-bromopyridin-2-yl)(1-methylpiperidin-4-yl)methanone (613678-08-3)

Guidance literature:

2,6-Dibromopyridine; With n-butyllithium; In hexane; tert-butyl methyl ether; at -75 - -65 ℃; for 1h;

N,N,1-trimethylpiperidine-4-carboxamide; In hexane; tert-butyl methyl ether; at -75 - -65 ℃; for 1h; Product distribution / selectivity;

Reference yield: 85.0%

(1-methyl-4-piperidyl)pyrrolidin-1-ylmethanone (613678-14-1) → (6-bromopyridin-2-yl)(1-methylpiperidin-4-yl)methanone (613678-08-3)

Guidance literature:

2,6-Dibromopyridine; With n-butyllithium; In hexane; tert-butyl methyl ether; at -72 - -67 ℃; for 0.666667h;

(1-methyl-4-piperidyl)pyrrolidin-1-ylmethanone; In hexane; tert-butyl methyl ether; at -75 - -69 ℃; for 1.33333h; Product distribution / selectivity;

Reference yield: 74.0%

1-methyl-piperidine-4-carboxylic acid methoxy-methyl-amide (215950-19-9) → (6-bromopyridin-2-yl)(1-methylpiperidin-4-yl)methanone (613678-08-3)

Guidance literature:

2,6-Dibromopyridine; In hexane; dichloromethane; at -78 ℃; for 1h;

1-methyl-piperidine-4-carboxylic acid methoxy-methyl-amide; In hexane; dichloromethane; at -78 - 20 ℃; Product distribution / selectivity;

upstream raw materials:

1-methyl-piperidine-4-carboxylic acid methoxy-methyl-amide

N,N,1-trimethylpiperidine-4-carboxamide

(1-methyl-4-piperidyl)pyrrolidin-1-ylmethanone

2,6-Dibromopyridine

Downstream raw materials:

(6-aminopyridin-2-yl)(1-methylpiperidin-4-yl)methanone

Refernces

• 1、 -. "PYRIDINOYLPIPERIDINES AS 5-HT1F AGONISTS". Page/Page column 42; 43. . Retrieved 2008/06/13.