tert-butyl (1R,3R,5R)-3-carbamoyl-2-azabicyclo[3.1.0]hexane-2-carboxylate - ≥97% , CAS No.1564266-54-1

CAS: 1564266-54-1 Cat. No.: T635659 Molecular Weight: 226.28 PubChem CID: 98005397

GRADE & PURITY ≥97%

Synonyms

1564266-54-1 | tert-Butyl (1R,3R,5R)-3-carbamoyl-2-azabicyclo[3.1.0]hexane-2-carboxylate | tert-Butyl(1R,3R,5R)-3-carbamoyl-2-azabicyclo[3.1.0]hexane-2-carboxylate | SCHEMBL21260191 | MFCD31743235 | D96765 | (1R,3R,5R)-2-Boc-3-carbamoyl-2-azabicyclo[3.1.0

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1564266-54-1 | tert-Butyl (1R, 3R, 5R)-3-carbamoyl-2-azabicyclo[3.1.0]hexane-2-carboxylate | tert-Butyl(1R, 3R, 5R)-3-carbamoyl-2-azabicyclo[3.1.0]hexane-2-carboxylate | SCHEMBL21260191 | MFCD31743235 | D96765 | (1R, 3R, 5R)-2-Boc-3-carbamoyl-2-azabicyclo[3.1.0

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC(C)(C)OC(=O)N1C2CC2CC1C(=O)N
• IUPAC Name: tert-butyl (1R,3R,5R)-3-carbamoyl-2-azabicyclo[3.1.0]hexane-2-carboxylate
• InChIKey: VLAGXRRGXCNITB-BWZBUEFSSA-N
• INCHI: 1S/C11H18N2O3/c1-11(2,3)16-10(15)13-7-4-6(7)5-8(13)9(12)14/h6-8H,4-5H2,1-3H3,(H2,12,14)/t6-,7-,8-/m1/s1
• Isomeric SMILES: CC(C)(C)OC(=O)N1[C@@H]2C[C@@H]2C[C@@H]1C(=O)N
• PubChem CID: 98005397
• Molecular Weight: 226.28

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Alpha amino acid amides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acid amides
• Alternative Parents: Piperidinecarboxylic acids Piperidinecarboxamides Pyrrolidinecarboxamides Pyrrolidine carboxylic acids Carbamate esters Primary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Alpha-amino acid amide - 2-piperidinecarboxamide - Piperidinecarboxamide - Piperidinecarboxylic acid - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Piperidine - Carbamic acid ester - Pyrrolidine - Carboxamide group - Primary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aliphatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y