Cas no 254905-58-3 (tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate)

Tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate is a versatile intermediate in organic synthesis, particularly in pharmaceutical and agrochemical applications. Its key structural features include a piperidine core with a dimethylcarbamoyl substituent at the 4-position and a Boc (tert-butoxycarbonyl) protecting group at the 1-position. The Boc group enhances stability and facilitates selective deprotection under mild acidic conditions, making it valuable in multi-step syntheses. The dimethylcarbamoyl moiety contributes to improved solubility and reactivity in further functionalization. This compound is commonly employed in the preparation of bioactive molecules, offering a balance of steric protection and synthetic flexibility. Its high purity and well-characterized properties ensure reproducibility in research and industrial processes.
tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate structure
254905-58-3 structure
Product Name:tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate
CAS No:254905-58-3
MF:C13H24N2O3
MW:256.341263771057
MDL:MFCD07776586
CID:246758
PubChem ID:11021505
Update Time:2025-05-20

tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate
    • 1-BOC-4-DIMETHYLCARBAMOYLPIPERIDINE
    • 1-Piperidinecarboxylicacid, 4-[(dimethylamino)carbonyl]-, 1,1-dimethylethyl ester
    • N-BOC-4-(dimethylcarbamoyl)piperidine
    • 4-(dimethylcarbamoyl)piperidine-1-carboxylic acid tert-butyl ester
    • AKOS000164112
    • EN300-3550397
    • VRVUOIHXJJWKIY-UHFFFAOYSA-N
    • 4-dimethylcarbamoyl-piperidine-1-carboxylic acid tert-butyl ester
    • SCHEMBL1087013
    • BS-24881
    • SB43441
    • AM807716
    • Octafoniumchloride
    • 254905-58-3
    • tert-butyl-4-(dimethylcarbamoyl)piperidine-1-carboxylate
    • DTXSID30452250
    • CS-0188262
    • Z100642480
    • MFCD07776586
    • 4-[dimethylamino(oxo)methyl]-1-piperidinecarboxylic acid tert-butyl ester
    • FT-0652607
    • A817876
    • Tert-butyl4-(dimethylcarbamoyl)piperidine-1-carboxylate
    • 1-Boc-N,N-dimethylpiperidine-4-carboxamide
    • DB-067411
    • SY333450
    • MDL: MFCD07776586
    • Inchi: 1S/C13H24N2O3/c1-13(2,3)18-12(17)15-8-6-10(7-9-15)11(16)14(4)5/h10H,6-9H2,1-5H3
    • InChI Key: VRVUOIHXJJWKIY-UHFFFAOYSA-N
    • SMILES: O(C(C)(C)C)C(N1CCC(C(N(C)C)=O)CC1)=O

Computed Properties

  • Exact Mass: 256.17900
  • Monoisotopic Mass: 256.17869263g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 5
  • Complexity: 313
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.1
  • Topological Polar Surface Area: 49.8?2

Experimental Properties

  • PSA: 49.85000
  • LogP: 1.65960

tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Additional information on tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate

Comprehensive Guide to tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate (CAS No. 254905-58-3)

tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate (CAS No. 254905-58-3) is a versatile piperidine derivative widely used in pharmaceutical research and organic synthesis. This compound, often referred to as a Boc-protected piperidine carbamate, plays a crucial role in medicinal chemistry due to its unique structural properties. Researchers and chemists frequently search for high-purity tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate to ensure optimal results in their experiments.

The molecular structure of tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate features both a tert-butoxycarbonyl (Boc) protecting group and a dimethylcarbamoyl moiety, making it particularly valuable for peptide synthesis and drug discovery. Recent trends in pharmaceutical development have increased demand for this compound, especially in the creation of small molecule inhibitors and kinase modulators. Many researchers are actively investigating its potential applications in neurological disorder treatments and metabolic disease research.

From a synthetic chemistry perspective, tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate serves as an excellent building block for more complex molecular architectures. Its stability under various reaction conditions makes it particularly useful for multi-step organic synthesis. The compound's CAS number 254905-58-3 is frequently searched in chemical databases, highlighting its importance in current research projects.

The pharmaceutical industry has shown growing interest in piperidine-based compounds like tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate due to their potential in developing new central nervous system (CNS) drugs. This aligns with current healthcare trends focusing on neurodegenerative disease treatments and pain management solutions. The compound's structural features allow for easy modification, making it a valuable scaffold in drug design optimization.

Quality control is paramount when working with tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate, as impurities can significantly affect research outcomes. Reputable suppliers typically provide detailed analytical certificates including HPLC purity data and spectroscopic characterization (NMR, MS). Researchers often search for CAS 254905-58-3 specifications to ensure they're obtaining material suitable for their specific applications.

In the context of green chemistry initiatives, the synthesis and handling of tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate have evolved to incorporate more sustainable practices. This includes optimizing reaction conditions to minimize waste and exploring catalytic methods for its production. Such developments address the growing demand for environmentally friendly chemical processes in the pharmaceutical industry.

The storage and handling of tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate require standard laboratory precautions. While not classified as hazardous under normal conditions, proper chemical storage protocols should always be followed. The compound's stability makes it suitable for long-term storage when kept in appropriate conditions, a feature particularly valued by research institutions maintaining chemical inventories.

Market analysis indicates steady growth in demand for specialty chemicals like tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate, driven by expanding pharmaceutical R&D budgets worldwide. The compound's CAS registry number 254905-58-3 appears in numerous patent applications, demonstrating its utility in intellectual property development within the drug discovery sector.

Recent scientific publications have highlighted novel applications of tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate in asymmetric synthesis and chiral auxiliary development. These advancements align with current trends in stereoselective synthesis, a hot topic in modern organic chemistry. Researchers are particularly interested in how this compound can contribute to the synthesis of enantiomerically pure pharmaceuticals.

The future outlook for tert-Butyl 4-(dimethylcarbamoyl)piperidine-1-carboxylate appears promising, with potential applications extending beyond traditional pharmaceutical uses. Emerging research suggests possible utility in material science and catalysis, areas that are currently receiving significant research attention. As synthetic methodologies continue to advance, the versatility of this piperidine derivative will likely lead to even broader applications across chemical disciplines.

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