Basic information
- Standard SMILES
Cc1cccnc1CCCCN.O=S(=O)(O)O- InChIKey
QSOQAAJUFTXLFT-UHFFFAOYSA-N- Molecular formula
- C10H18N2O4S
- Average molar mass
- 262.33 g/mol
- Monoisotopic mass
- 262.09872823
Names & identifiers
- Preferred name
- 2-(4-Aminobutyl)-3-methylpyridine sulphate
- IUPAC
- 4-(3-methyl-2-pyridinyl)butan-1-amine;sulfuric acid
Names & synonyms
SCHEMBL10701425QSOQAAJUFTXLFT-UHFFFAOYSA-N2-(4-aminobutyl)-3-methylpyridine sulphate
Database identifiers
- PubChem CID
- 70422993
Properties
Computed structural properties
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 196
Related reactions
2 records
Compound notes
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