Basic information
- Standard SMILES
Cc1nc2c(n1C)CCc1ccccc1C2=C1CCN(C)CC1- InChIKey
LTSBIXXGGZWKMV-UHFFFAOYSA-N- Molecular formula
- C20H25N3
- Average molar mass
- 307.4 g/mol
- Monoisotopic mass
- 307.20484781
Names & identifiers
- Preferred name
- 5,6-Dimethyl-2-(1-methylpiperidin-4-ylidene)-4,6-diazatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaene
- IUPAC
- 5,6-dimethyl-2-(1-methylpiperidin-4-ylidene)-4,6-diazatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaene
Names & synonyms
DTXSID6013843405,6-Dimethyl-2-(1-methylpiperidin-4-ylidene)-4,6-diazatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaene
Database identifiers
- PubChem CID
- 40951
- DTXSID
DTXSID601384340
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 21.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 462
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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