Basic information
- Standard SMILES
C[N@@+]1(CC(=O)Nc2cnccn2)CCC(O)C1.[Br-]- InChIKey
XTZDTJJYCBBUOD-FDDQUTDISA-N- Molecular formula
- C11H17BrN4O2
- Average molar mass
- 317.18 g/mol
- Monoisotopic mass
- 316.05349
Names & identifiers
- Preferred name
- (R)-3-hydroxy-1-methyl-1-(pyrazin-2-ylcarbamoylmethyl)-pyrrolidinium bromide
- IUPAC
- 2-[(1R)-3-hydroxy-1-methylpyrrolidin-1-ium-1-yl]-N-pyrazin-2-ylacetamide bromide
Names & synonyms
SCHEMBL1716629XTZDTJJYCBBUOD-FDDQUTDISA-N(R)-3-hydroxy-1-methyl-1-(pyrazin-2-ylcarbamoylmethyl)-pyrrolidinium bromide
Database identifiers
- PubChem CID
- 87282153
Properties
Computed structural properties
- Topological polar surface area
- 75.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 287
Related reactions
2 records
Compound notes
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