1-(4-Aminopiperidin-1-yl)-2-methylpropan-1-one

Base Information

• Chemical Name: 1-(4-Aminopiperidin-1-yl)-2-methylpropan-1-one
• CAS No.: 172478-05-6
• Molecular Formula: C₉H₁₈N₂O
• Molecular Weight: 170.255
• Hs Code.: 2933399090
• European Community (EC) Number: 678-962-1
• DSSTox Substance ID: DTXSID70588224
• Wikidata: Q82480764
• Mol file: 172478-05-6.mol

Synonyms:1-(4-aminopiperidin-1-yl)-2-methylpropan-1-one;172478-05-6;4-Amino-1-isobutyrylpiperidine;1-isobutyrylpiperidin-4-amine;880361-98-8;1-isobutyryl-4-piperidinamine;4-Piperidinamine, 1-(2-methyl-1-oxopropyl)-;SCHEMBL3059596;DTXSID70588224;LULDRPDOMFMBIC-UHFFFAOYSA-N;XGA47805;MFCD08061057;STK360674;AKOS000129351;MCULE-1120148894;SB42533;AS-67192;DB-102641;CS-0139090;EN300-31851;D86958;1-(4-AMINOPIPERIDINO)-2-METHYL-1-PROPANONE;Z239097486

Chemical Property of 1-(4-Aminopiperidin-1-yl)-2-methylpropan-1-one

Chemical Property:

• Vapor Pressure: 0.002mmHg at 25°C
• Boiling Point: 295.534°C at 760 mmHg
• Flash Point: 132.535°C
• PSA: 46.33000
• Density: 1.003g/cm³
• LogP: 1.23030
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 170.141913202
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

99% ^*data from raw suppliers

1-ISOBUTYRYLPIPERIDIN-4-AMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1-(4-Aminopiperidin-1-yl)-2-methylpropan-1-one

There total 5 articles about 1-(4-Aminopiperidin-1-yl)-2-methylpropan-1-one 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: 87.0%

3-<(t-butyloxycarbonyl)methylamino>-1-propionyl-piperidine (172478-03-4) → 3-methylamino-1-propionyl-piperidine (172478-05-6)

Guidance literature:

With hydrogenchloride; In diethyl ether; Ambient temperature;

DOI:10.1016/0040-4020(95)00716-L

Reference yield:

1-benzyl-3-piperidone (40114-49-6) → 3-methylamino-1-propionyl-piperidine (172478-05-6)

Guidance literature:

Multi-step reaction with 5 steps

1: 71 percent / NaBH₄ / methanol; H₂O / 1 h / Ambient temperature

2: 85 percent / CH₂Cl₂

3: 90 percent / H₂ / 10percent Pd/C / ethanol / Ambient temperature

4: 80 percent / 1 h / 100 °C

5: 87 percent / HCl / diethyl ether / Ambient temperature

With hydrogenchloride; sodium tetrahydroborate; hydrogen; palladium on activated charcoal; In methanol; diethyl ether; ethanol; dichloromethane; water;

DOI:10.1016/0040-4020(95)00716-L

Reference yield:

1-benzyl-N-methylpiperidin-3-amine (60717-45-5) → 3-methylamino-1-propionyl-piperidine (172478-05-6)

Guidance literature:

Multi-step reaction with 4 steps

1: 85 percent / CH₂Cl₂

2: 90 percent / H₂ / 10percent Pd/C / ethanol / Ambient temperature

3: 80 percent / 1 h / 100 °C

4: 87 percent / HCl / diethyl ether / Ambient temperature

With hydrogenchloride; hydrogen; palladium on activated charcoal; In diethyl ether; ethanol; dichloromethane;

DOI:10.1016/0040-4020(95)00716-L

upstream raw materials:

3-<(t-butyloxycarbonyl)methylamino>-1-propionyl-piperidine

1-benzyl-3-piperidone

1-benzyl-N-methylpiperidin-3-amine

3-<(t-butyloxycarbonyl)methylamino>-piperidine