Tert-butyl 4-(4-aminopiperidin-1-YL)piperidine-1-carboxylate

Base Information

• Chemical Name: Tert-butyl 4-(4-aminopiperidin-1-YL)piperidine-1-carboxylate
• CAS No.: 959237-16-2
• Molecular Formula: C₁₅H₂₉N₃O₂
• Molecular Weight: 283.414
• DSSTox Substance ID: DTXSID00697035
• Wikidata: Q72438283
• Mol file: 959237-16-2.mol

Synonyms:959237-16-2;TERT-BUTYL 4-(4-AMINOPIPERIDIN-1-YL)PIPERIDINE-1-CARBOXYLATE;tert-butyl 4-amino-[1,4'-bipiperidine]-1'-carboxylate;MFCD09864242;tert-butyl 4-amino-1,4'-bipiperidine-1'-carboxylate;SCHEMBL4161964;DTXSID00697035;AKOS007930561;1'-Boc-4-amino-[1,4'-bipiperidine];AM804618;AS-68869;SY124095;CS-0036248;FT-0762076;A25955;EN300-240388;W15140;tert-Butyl4-amino-1,4'-bipiperidine-1'-carboxylate;tert-butyl4-amino-[1,4'-bipiperidine]-1'-carboxylate;F2167-0878;tert-Butyl 4-amino[1,4'-bipiperidine]-1'-carboxylate;Z1505698968;1 inverted exclamation mark -Boc-[1,4 inverted exclamation mark -bipiperidin]-4-amine

Chemical Property of Tert-butyl 4-(4-aminopiperidin-1-YL)piperidine-1-carboxylate

Chemical Property:

• Boiling Point: 378.9±42.0 °C(Predicted)
• PKA: 10.45±0.20(Predicted)
• Density: 1.075
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 283.22597718
• Heavy Atom Count: 20
• Complexity: 325

Purity/Quality:

99%, ^*data from raw suppliers

tert-Butyl4-amino-[1,4'-bipiperidine]-1'-carboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCC(CC1)N2CCC(CC2)N

Technology Process of Tert-butyl 4-(4-aminopiperidin-1-YL)piperidine-1-carboxylate

There total 5 articles about Tert-butyl 4-(4-aminopiperidin-1-YL)piperidine-1-carboxylate 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: 99.6%

tert-butyl 4-(((benzyloxy)carbonyl)amino)-[1,4'-bipiperidine]-1'-carboxylate → tert-butyl 4-(4-amino-1-piperidyl)piperidine-1-carboxylate (959237-16-2)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; at 20 ℃; for 20h; under 760.051 Torr;

DOI:10.1016/j.ejmech.2017.03.013

Reference yield:

piperidin-4-ylcarbamic acid benzyl ester (182223-54-7) → tert-butyl 4-(4-amino-1-piperidyl)piperidine-1-carboxylate (959237-16-2)

Guidance literature:

Multi-step reaction with 2 steps

1.1: N-ethyl-N,N-diisopropylamine / tetrahydrofuran / 1.5 h / 20 °C

1.2: 20 °C

2.1: hydrogen; palladium 10% on activated carbon / 20 h / 20 °C / 760.05 Torr

With palladium 10% on activated carbon; hydrogen; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran;

DOI:10.1016/j.ejmech.2017.03.013

Reference yield:

tert-butyl 4-(4-oxo-1-piperidyl)piperidine-1-carboxylate (1185732-60-8) → tert-butyl 4-(4-amino-1-piperidyl)piperidine-1-carboxylate (959237-16-2)

Guidance literature:

With palladium 10% on activated carbon; ammonia; ammonium formate; In methanol; at 20 ℃;

upstream raw materials:

4-(benzyloxycarbonylamino)-1-(tert-butoxycarbonyl)piperidine

1-(tert-butoxycarbonyl)-4-aminopiperidine

piperidin-4-ylcarbamic acid benzyl ester

tert-butyl 4-(4-oxo-1-piperidyl)piperidine-1-carboxylate

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