Basic information
- Standard SMILES
CCCN(CCCCN)c1ccccn1- InChIKey
MTSFOMHMPQMRCU-UHFFFAOYSA-N- Molecular formula
- C12H21N3
- Average molar mass
- 207.32 g/mol
- Monoisotopic mass
- 207.17354768
Names & identifiers
- Preferred name
- 2-[N-(4-aminobutyl)-N-propylamino]pyridine
- IUPAC
- N'-propyl-N'-pyridin-2-ylbutane-1,4-diamine
Names & synonyms
SCHEMBL10651082MTSFOMHMPQMRCU-UHFFFAOYSA-N2-[N-(4-aminobutyl)-N-propylamino]pyridine
Database identifiers
- PubChem CID
- 20186617
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 150
Related reactions
9 records
Compound notes
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