Basic information
- Standard SMILES
Cc1noc(C)c1-c1cncc(N2CC3CC4CC2CN(C4)C3)c1- InChIKey
YWVOGOKVELDKRZ-UHFFFAOYSA-N- Molecular formula
- C19H24N4O
- Average molar mass
- 324.4 g/mol
Names & identifiers
- Preferred name
- 4-[5-(3,5-Dimethylisoxazol-4-yl)pyridin-3-yl]-1,4-diazatricyclo[4.3.1.13,8]undecane
- IUPAC
- 4-[5-(1,4-diazatricyclo[4.3.1.13,8]undecan-4-yl)-3-pyridinyl]-3,5-dimethyl-1,2-oxazole
Names & synonyms
YWVOGOKVELDKRZ-UHFFFAOYSA-N4-[5-(3,5-dimethylisoxazol-4-yl)pyridin-3-yl]-1,4-diazatricyclo[4.3.1.13,8]undecane
Database identifiers
- PubChem CID
- 49869429
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 45.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 474
Related reactions
1 records
Compound notes
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