Cas no 1367945-56-9 (tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate)

Tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate is a chiral piperidine derivative widely used as a key intermediate in pharmaceutical synthesis and organic chemistry. Its rigid trans-configuration and stereochemical purity make it valuable for constructing complex molecules with high enantioselectivity. The tert-butyloxycarbonyl (Boc) protecting group enhances stability, allowing for selective deprotection under mild acidic conditions. The presence of both amino and carboxylate functionalities enables versatile reactivity in peptide coupling, heterocycle formation, and catalyst design. This compound is particularly useful in medicinal chemistry for developing bioactive compounds, including CNS-targeting agents, due to its structural resemblance to pharmacologically active piperidine scaffolds. Its well-defined stereochemistry ensures reproducible results in asymmetric synthesis.
tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate structure
1367945-56-9 structure
Product Name:tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate
CAS No:1367945-56-9
MF:C11H22N2O2
MW:214.304583072662
CID:2157993
Update Time:2025-05-25

tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Trans-tert-butyl 3-amino-2-methylpiperidine-1-carboxylate
    • (2R,3S)-tert-Butyl 3-amino-2-methylpiperidine-1-carboxylate
    • TERT-BUTYL (2R,3S)-3-AMINO-2-METHYLPIPERIDINE-1-CARBOXYLATE
    • tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate
    • Inchi: 1S/C11H22N2O2/c1-8-9(12)6-5-7-13(8)10(14)15-11(2,3)4/h8-9H,5-7,12H2,1-4H3/t8-,9+/m1/s1
    • InChI Key: ZGIHBYXILBKXGA-BDAKNGLRSA-N
    • SMILES: O(C(C)(C)C)C(N1CCC[C@@H]([C@H]1C)N)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 235
  • Topological Polar Surface Area: 55.6

tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
NAN JING YAO SHI KE JI GU FEN Co., Ltd.
PBZ4883-100MG
tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
100MG
¥ 1,412.00 2023-04-04
NAN JING YAO SHI KE JI GU FEN Co., Ltd.
PBZ4883-250MG
tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
250MG
¥ 2,257.00 2023-04-04
NAN JING YAO SHI KE JI GU FEN Co., Ltd.
PBZ4883-500MG
tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
500MG
¥ 3,755.00 2023-04-04
NAN JING YAO SHI KE JI GU FEN Co., Ltd.
PBZ4883-1G
tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
1g
¥ 5,629.00 2023-04-04
NAN JING YAO SHI KE JI GU FEN Co., Ltd.
PBZ4883-5G
tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
5g
¥ 16,889.00 2023-04-04
Enamine
EN300-6482640-0.05g
rel-tert-butyl (2R,3S)-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
0.05g
$629.0 2023-05-31
Enamine
EN300-6482640-0.1g
rel-tert-butyl (2R,3S)-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
0.1g
$822.0 2023-05-31
Enamine
EN300-6482640-0.25g
rel-tert-butyl (2R,3S)-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
0.25g
$1173.0 2023-05-31
Enamine
EN300-6482640-0.5g
rel-tert-butyl (2R,3S)-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
0.5g
$1849.0 2023-05-31
Enamine
EN300-6482640-1.0g
rel-tert-butyl (2R,3S)-3-amino-2-methylpiperidine-1-carboxylate
1367945-56-9 95%
1g
$2371.0 2023-05-31

tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate Related Literature

Additional information on tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate

Comprehensive Overview of tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate (CAS No. 1367945-56-9)

tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate (CAS No. 1367945-56-9) is a highly specialized organic compound widely utilized in pharmaceutical research and fine chemical synthesis. This piperidine derivative is particularly valued for its role as a key intermediate in the development of bioactive molecules, including potential drug candidates. The compound's unique structural features, such as the tert-butyl protecting group and the trans-3-amino-2-methyl configuration, contribute to its versatility in medicinal chemistry applications.

In recent years, the demand for piperidine derivatives like tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate has surged due to their importance in designing novel therapeutic agents. Researchers frequently search for "CAS 1367945-56-9 applications" or "synthesis of tert-butyl protected amino piperidines," reflecting the compound's relevance in modern drug discovery. Its stability under various reaction conditions makes it particularly useful for constructing complex molecular architectures, a topic of growing interest in AI-assisted drug design and computational chemistry workflows.

The compound's stereochemistry is another critical aspect that attracts scientific attention. The trans configuration at positions 2 and 3 of the piperidine ring often leads to distinct biological activities compared to its cis counterparts. This property aligns with current trends in chiral drug development, where researchers increasingly focus on "stereoselective synthesis" methods to create more effective and safer medications. The presence of both amino and carboxylate functional groups in the molecule provides multiple sites for further chemical modifications.

From a synthetic chemistry perspective, tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate serves as a valuable building block for constructing various heterocyclic systems. Its Boc-protected amine (tert-butoxycarbonyl) group offers excellent stability during synthetic transformations while allowing for selective deprotection when needed. This characteristic makes the compound particularly useful in peptide mimetics development and fragment-based drug discovery, two areas experiencing significant growth in pharmaceutical research.

The compound's physicochemical properties have been the subject of numerous studies, with researchers frequently investigating its "solubility profile" and "crystallization behavior." These characteristics are crucial for process chemistry applications and formulation development. Recent advances in green chemistry have also prompted investigations into more sustainable production methods for this intermediate, addressing growing concerns about environmental impact in chemical manufacturing.

In analytical applications, tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate often serves as a reference standard for method development in HPLC and LC-MS analyses. Its well-defined structure and stability make it ideal for calibrating instruments and validating analytical procedures, especially in quality control laboratories serving the pharmaceutical industry. The compound's spectral data (NMR, IR, and mass spectra) are frequently requested by researchers working on structural elucidation of similar compounds.

The growing interest in neuropharmaceuticals and CNS-targeted therapies has further increased the relevance of this piperidine derivative. Many current searches relate to its potential application in developing neuromodulators or receptor ligands, reflecting the compound's importance in neuroscience research. Its structural similarity to various bioactive natural products continues to inspire novel synthetic approaches in academic and industrial laboratories worldwide.

As the pharmaceutical industry increasingly adopts continuous manufacturing and flow chemistry technologies, intermediates like tert-butyl trans-3-amino-2-methylpiperidine-1-carboxylate are being reevaluated for their compatibility with these advanced production methods. This aligns with broader industry trends toward more efficient and scalable synthetic processes, making the compound's study particularly timely and relevant for modern chemical development.

Recommended suppliers
Shanghai Aoguang Biotechnology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Aoguang Biotechnology Co., Ltd
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Inner Mongolia Xinhong Biological Technology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Inner Mongolia Xinhong Biological Technology Co., Ltd
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
ASIACHEM I&E (JIANGSU) CO., LTD