Basic information
- Standard SMILES
COCC(=O)NCC(=O)N1CC1C#N- InChIKey
JYMBBLGHGHYXBQ-UHFFFAOYSA-N- Molecular formula
- C8H11N3O3
- Average molar mass
- 197.19 g/mol
Names & identifiers
- Preferred name
- 1-(N-Methoxyacetylglycyl)-2-cyanoaziridine
- IUPAC
- N-[2-(2-cyanoaziridin-1-yl)-2-oxoethyl]-2-methoxyacetamide
Names & synonyms
SCHEMBL11385498JYMBBLGHGHYXBQ-UHFFFAOYSA-N1-(N-Methoxyacetylglycyl)-2-cyanoaziridine
Database identifiers
- PubChem CID
- 23461589
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 82.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 293
Related reactions
2 records
Compound notes
Loading…