N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide

Base Information

Chemical Name:N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide
CAS No.:630116-49-3
Molecular Formula:C19H23N3O
Molecular Weight:309.411
Hs Code.:2933990090
UNII:RWL9H93ARB
DSSTox Substance ID:DTXSID70212234
Wikipedia:A-412997
Wikidata:Q4646874
Pharos Ligand ID:8UDKJRRN4D2M
ChEMBL ID:CHEMBL375596
Mol file:630116-49-3.mol

Synonyms:2-(3',4',5',6'-tetrahydro-2'H-(2,4') bipyridinyl-1'-yl)-N-m-tolyl-acetamide;A-412997

Suppliers and Price of N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
A-412997
150mg
$ 175.00

American Custom Chemicals Corporation
A-412997 DIHYDROCHLORIDE 98.00%
10MG
$ 284.55

AK Scientific
A-412997 dihydrochloride
100mg
$ 750.00

Total 6 raw suppliers

Chemical Property of N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide

Chemical Property:

Boiling Point:514.0±50.0 °C(Predicted)
PKA:14.69±0.70(Predicted)
PSA：48.72000
Density:1.147±0.06 g/cm3(Predicted)
LogP:3.79550
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:309.184112366
Heavy Atom Count:23
Complexity:379

Purity/Quality:

97% ^*data from raw suppliers

A-412997 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=CC=C1)NC(=O)CN2CCC(CC2)C3=CC=CC=N3
Uses Acts as a selective agonist against dopamine D4 receptors, which affect cognitive performance and activity.

Technology Process of N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide

There total 3 articles about N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide 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: 71.0%

: 5439-17-8
2-bromo-N-(3-methylphenyl)acetamide

: 30532-37-7
4-(2-pyridinyl)piperidine

: 630116-49-3
N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide

Guidance literature:: With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 18h;
DOI:10.1021/jm060662k

Reference yield: 55.0%

: 630116-49-3
N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide

Guidance literature:

Reference yield:

: 108-44-1
1-amino-3-methylbenzene

: 630116-49-3
N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide

Guidance literature:: Multi-step reaction with 2 steps

1: aq. NaOH / CH₂Cl₂ / 20 °C

2: 71 percent / K₂CO₃ / dimethylformamide / 18 h / 20 °C

With sodium hydroxide; potassium carbonate; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1021/jm060662k