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Basic information
- Standard SMILES
CC(=O)Nc1c(C#N)c2n(c1C(=O)O)CCC2- InChIKey
CQWZHIIAOZELRZ-UHFFFAOYSA-N- Molecular formula
- C11H11N3O3
- Average molar mass
- 233.22 g/mol
- Monoisotopic mass
- 233.08004122
Names & identifiers
- Preferred name
- 2-acetamido-1-cyano-6,7-dihydro-5H-pyrrolizine-3-carboxylic acid
- IUPAC
- 2-acetamido-1-cyano-6,7-dihydro-5H-pyrrolizine-3-carboxylic acid
Names & synonyms
NSC6967967-cyano-6-acetamido-2,3-dihydro-1H-pyrrolizine-5-carboxylic acid211817-70-82-acetamido-1-cyano-6,7-dihydro-5H-pyrrolizine-3-carboxylic acid6-(Acetylamino)-7-cyano-2,3-dihydro-1H-pyrrolizine-5-carboxylic acidNSC-696796EN300-45377550
Database identifiers
- PubChem CID
- 393869
Properties
Computed structural propertiesFilling in
- XLogP
- 0.3
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 400
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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