(s)-1-Boc-3-(aminomethyl)piperidine

Base Information

• Chemical Name: (s)-1-Boc-3-(aminomethyl)piperidine
• CAS No.: 140645-24-5
• Molecular Formula: C11H22N2O2
• Molecular Weight: 214.308
• Hs Code.: 29333990
• European Community (EC) Number: 676-059-7
• DSSTox Substance ID: DTXSID40363585
• Nikkaji Number: J2.154.468J
• Wikidata: Q72448255
• Mol file: 140645-24-5.mol

Synonyms:140645-24-5;(s)-1-boc-3-(aminomethyl)piperidine;(s)-n-boc-3-aminomethylpiperidine;(s)-tert-butyl 3-(aminomethyl)piperidine-1-carboxylate;(S)-1-N-Boc-3-(aminomethyl)piperidine;(s)-3-(aminomethyl)-1-n-boc-piperidine;(S)-3-Aminomethyl-1-Boc-piperidine;tert-butyl (3S)-3-(aminomethyl)piperidine-1-carboxylate;MFCD03839877;(3S)-1-Boc-3-(aminomethyl)piperidine;(s)-3-aminomethyl-piperidine-1-carboxylic acid tert-butyl ester;(s)-1-boc-3-(aminomethyl) piperidine;(s)-1-n-boc-piperidine-3-methylamine;(3s)-3-(aminomethyl)piperidine, n1-boc protected;(3S)-3-Aminomethyl-N-tert-butoxycarbonylpiperidine;SCHEMBL640559;tert-butyl (S)-3-(aminomethyl)piperidine-1-carboxylate;DTXSID40363585;(s)-1-boc-3-aminomethylpiperidine;(s)3-aminomethyl-piperidine-1-carboxylic acid tert-butyl ester;AKOS005258687;(s)-3-aminomethyl-1-n-boc-piperidine;CS-W008690;1-PIPERIDINECARBOXYLIC ACID, 3-(AMINOMETHYL)-, 1,1-DIMETHYLETHYL ESTER, (3S)-;AC-24269;AM803201;(S)-1-Boc-3-(aminomethyl)piperidine, 95%;A13599;EN300-114111;(S)-1-Boc-3-(aminomethyl)piperidine, AldrichCPR;t-butyl (S)-3-aminomethyl-1-piperidinecarboxylate;Q-102964;(s)-t-butyl 3-(aminomethyl)piperidine-1-carboxylate;(s)-tert-butyl-3-(aminomethyl)piperidine-1-carboxylate;3(s)-aminomethyl-piperidine-1-carboxylic acid tert-butyl ester;1,1-dimethylethyl (3S)-3-(aminomethyl)-1-piperidinecarboxylate;(3S)-3alpha-(Aminomethyl)-1-piperidinecarboxylic acid tert-butyl ester;(S)-tert-butyl 3-(aminomethyl)piperidine-1-carboxylate;(S)-1-Boc-3-(Aminomethyl)piperidine

Chemical Property of (s)-1-Boc-3-(aminomethyl)piperidine

Chemical Property:

• Vapor Pressure: 0.00119mmHg at 25°C
• Refractive Index: 1.481
• Boiling Point: 299.4 °C at 760 mmHg
• PKA: 10.12±0.29(Predicted)
• Flash Point: 134.9 °C
• PSA: 55.56000
• Density: 1.023 g/cm³
• LogP: 2.23040
• Storage Temp.: Room temperature.
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 214.168127949
• Heavy Atom Count: 15
• Complexity: 223

Purity/Quality:

99%, ^*data from raw suppliers

(S)-1-Boc-3-(Aminomethyl)piperidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn,N
• Statements: 22-50-36/37/38
• Safety Statements: 26-61-37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCCC(C1)CN
• Isomeric SMILES: CC(C)(C)OC(=O)N1CCC[C@H](C1)CN
• Uses: (S)-1-Boc-3-(Aminomethyl)piperidine is an isoquinoline derivative used as SIK2 inhibitors.

Technology Process of (s)-1-Boc-3-(aminomethyl)piperidine

There total 7 articles about (s)-1-Boc-3-(aminomethyl)piperidine 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: 100.0%

(R)-3-(azidomethyl)piperidine-1-carboxylic acid tert-butyl ester (155541-67-6) → tert-butyl (3S)-3-(aminomethyl)piperidine-1-carboxylate (140645-24-5)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol;

DOI:10.1248/cpb.53.437

Reference yield:

tert-butyl (3R)-3-(hydroxymethyl)piperidine-1-carboxylate (116574-71-1,140645-19-8,140695-84-7,140695-85-8) → tert-butyl (3S)-3-(aminomethyl)piperidine-1-carboxylate (140645-24-5)

Guidance literature:

Multi-step reaction with 3 steps

1: Et₃N / ethyl acetate

2: NaN₃ / dimethylformamide

3: 100 percent / H₂ / Pd/C / methanol

With sodium azide; hydrogen; triethylamine; palladium on activated charcoal; In methanol; ethyl acetate; N,N-dimethyl-formamide;

DOI:10.1248/cpb.53.437

Reference yield:

(R)-<<(methylsulfonyl)oxy>methyl>piperidine-1-carboxylic acid tert-butyl ester (161285-05-8) → tert-butyl (3S)-3-(aminomethyl)piperidine-1-carboxylate (140645-24-5)

Guidance literature:

Multi-step reaction with 2 steps

1: NaN₃ / dimethylformamide

2: 100 percent / H₂ / Pd/C / methanol

With sodium azide; hydrogen; palladium on activated charcoal; In methanol; N,N-dimethyl-formamide;

DOI:10.1248/cpb.53.437

upstream raw materials:

(R)-3-(azidomethyl)piperidine-1-carboxylic acid tert-butyl ester

(R)-3-hydroxymethyl piperidine

tert-butyl (3R)-3-(hydroxymethyl)piperidine-1-carboxylate

(R)-<<(methylsulfonyl)oxy>methyl>piperidine-1-carboxylic acid tert-butyl ester

Downstream raw materials:

(S)-<<(benzyloxycarbonyl)amino>methyl>piperidine-1-carboxylic acid tert-butyl ester

(S)-3-[({(R)-1-[(2S,4R)-4-tert-Butoxy-1-(3,3,3-triphenyl-propionyl)-pyrrolidine-2-carbonyl]-pyrrolidine-2-carbonyl}-amino)-methyl]-piperidine-1-carboxylic acid tert-butyl ester

(R)-3-[(benzyloxycarbonylamino)methyl]-piperidine

(S)-tert-butyl 3-(((7-(4-morpholinophenyl)pyrido[4,3-b]pyrazin-5-yl)amino)methyl)piperidine-1-carboxylate

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