Basic information
- CAS
93263-07-1- Standard SMILES
Cn1cnc2nc3ncn(C)c3cc21- InChIKey
UQZJJRUYHHCWBZ-UHFFFAOYSA-N- Molecular formula
- C9H9N5
- Average molar mass
- 187.2 g/mol
- Monoisotopic mass
- 187.08579531
Names & identifiers
- Preferred name
- 1,7-Dimethyl-1,7-dihydrodiimidazo(4,5-b:4,5-e)pyridine
- IUPAC
- 6,10-dimethyl-2,4,6,10,12-pentazatricyclo[7.3.0.03,7]dodeca-1,3(7),4,8,11-pentaene
Names & synonyms
93263-07-1BHC2NG1HC31,7-Dimethyl-1,7-dihydrodiimidazo(4,5-b:4,5-e)pyridineUNII-BHC2NG1HC3NSC 99407NSC-99407DTXSID40239352DIIMIDAZO(4,5-B:4',5'-E)PYRIDINE, 1,7-DIHYDRO-1,7-DIMETHYL-1,7-Dimethyl-1,7-dihydrodiimidazo[4,5-b:4,5-e]pyridineRefChem:73683DTXCID60161843NSC99407
Show more names
1,7-dimethyl-1,7-dihydrodiimidazo[4,5-b:4',5'-e]pyridine1,7-dimethyldiimidazo[[?],[?]]pyridine
Database identifiers
- CAS
93263-07-1- PubChem CID
- 264347
- DTXSID
DTXSID40239352- UNII
- BHC2NG1HC3
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 211
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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