Basic information
- Standard SMILES
C[N+](C)(CCCN)CC(=O)c1ccc(N)cc1.[Cl-]- InChIKey
MSYMRIWXIITFTR-UHFFFAOYSA-N- Molecular formula
- C13H22ClN3O
- Average molar mass
- 271.78 g/mol
Names & identifiers
- Preferred name
- N,N-Dimethyl-N-(p-aminophenacyl)-N-3-aminopropylammonium chloride
- IUPAC
- [2-(4-aminophenyl)-2-oxoethyl]-(3-aminopropyl)-dimethylazanium chloride
Names & synonyms
SCHEMBL11441023MSYMRIWXIITFTR-UHFFFAOYSA-NN,N-Dimethyl-N-(p-aminophenacyl)-N-3-aminopropylammonium chloride
Database identifiers
- PubChem CID
- 86735871
Properties
Computed structural properties
- Topological polar surface area
- 69.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 245
Related reactions
4 records
Compound notes
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