Basic information
- Standard SMILES
NCCCCc1ncc(Br)cc1N- InChIKey
FYRUBSLHFRZUIB-UHFFFAOYSA-N- Molecular formula
- C9H14BrN3
- Average molar mass
- 244.13 g/mol
Names & identifiers
- Preferred name
- 3-Amino-5-bromo-(4-aminobutyl)pyridine
- IUPAC
- 2-(4-aminobutyl)-5-bromopyridin-3-amine
Names & synonyms
SCHEMBL10377543FYRUBSLHFRZUIB-UHFFFAOYSA-N3-amino-5-bromo-(4-aminobutyl)pyridine5-Bromo-2-(4-aminobutyl)-3-aminopyridine
Database identifiers
- PubChem CID
- 14537459
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 143
Related reactions
6 records
Compound notes
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