Basic information
- Standard SMILES
Oc1cc(Cc2cccnc2)cnc1NCCCC1CCCc2cccnc21- InChIKey
AVMIOSONWYDLMF-UHFFFAOYSA-N- Molecular formula
- C23H26N4O
- Average molar mass
- 374.5 g/mol
- Monoisotopic mass
- 374.21066147
Names & identifiers
- Preferred name
- 2-[3-(5,6,7,8-Tetrahydroquinol-8-yl)propylamino]-3-hydroxy-5-(pyrid-3-ylmethyl)pyridine
- IUPAC
- 5-(pyridin-3-ylmethyl)-2-[3-(5,6,7,8-tetrahydroquinolin-8-yl)propylamino]pyridin-3-ol
Names & synonyms
SCHEMBL10366993AVMIOSONWYDLMF-UHFFFAOYSA-N2-[3-(5,6,7,8-tetrahydroquinol-8-yl)propylamino]-3-hydroxy-5-(pyrid-3-ylmethyl)pyridine
Database identifiers
- PubChem CID
- 19851786
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 70.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 462
Related reactions
2 records
Compound notes
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