Description

Benzyl 2,5-diazaspiro[3.4]octane-5-carboxylate (CAS: 1160248-45-2) is a high-purity synthetic organic compound with the molecular formula C₁₄H₁₈N₂O₂. This spirocyclic derivative features a diazaspiro[3.4]octane core structure, functionalized with a benzyl carboxylate group, making it a valuable intermediate in pharmaceutical and agrochemical research. The compound is supplied as a white to off-white crystalline powder with ≥95% purity (HPLC), ensuring optimal performance in synthetic applications. Its unique spirocyclic architecture offers versatile reactivity for the development of novel bioactive molecules, particularly in medicinal chemistry for drug discovery programs. Proper storage at 2-8°C under inert atmosphere is recommended to maintain stability.

Properties

• CAS Number: 1160248-45-2
• Complexity: 309
• IUPAC Name: benzyl 2,5-diazaspiro[3.4]octane-5-carboxylate
• InChI: InChI=1S/C14H18N2O2/c17-13(18-9-12-5-2-1-3-6-12)16-8-4-7-14(16)10-15-11-14/h1-3,5-6,15H,4,7-11H2
• InChI Key: AESURKCEBCHDOL-UHFFFAOYSA-N
• Exact Mass: 246.136827821
• Molecular Formula: C14H18N2O2
• Molecular Weight: 246.30
• SMILES: C1CC2(CNC2)N(C1)C(=O)OCC3=CC=CC=C3
• Topological: 41.6
• Monoisotopic Mass: 246.136827821
• Synonyms: BENZYL 2,5-DIAZASPIRO[3.4]OCTANE-5-CARBOXYLATE, 1160248-45-2, benzyl2,5-diazaspiro[3.4]octane-5-carboxylate, benzyl2,5-diazaspiro[3.4]octane-5-carboxylate-B15471, AKOS025405313, PB19253, AS-69154, DB-369866, CS-0000667, P11437

Application

Benzyl 2,5-diazaspiro[3.4]octane-5-carboxylate serves as a key building block in the synthesis of pharmacologically active compounds, particularly those targeting central nervous system disorders. Its spirocyclic structure is utilized in the development of novel enzyme inhibitors and receptor modulators due to its constrained geometry. The compound finds application in parallel synthesis and combinatorial chemistry for the generation of diverse molecular libraries. Researchers employ this intermediate in peptidomimetic studies and as a scaffold for privileged structures in drug design.

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