Basic information
- CAS
519-61-9- Standard SMILES
C1=CC2=CC=CC3=CC=CC(=C1)N23- InChIKey
NYGOXVYQBYCRRU-UHFFFAOYSA-N- Molecular formula
- C12H9N
- Average molar mass
- 167.21 g/mol
- Monoisotopic mass
- 167.07349929
Names & identifiers
- Preferred name
- Pyrido(2,1,6-de)quinolizine
- IUPAC
- 13-azatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaene
Names & synonyms
Pyrido[2,1,6-de]quinolizine519-61-9Pyrido(2,1,6-de)quinolizineDTXSID40199861RefChem:377290DTXCID0012235213-azatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaeneSCHEMBL815003SCHEMBL4549618hydropyrido[2,1,6-de]quinolizine
Database identifiers
- CAS
519-61-9- PubChem CID
- 136343
- DTXSID
DTXSID40199861- Nikkaji
- J11.787K
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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