Basic information
- Standard SMILES
CCCCCOc1c[nH]nc1C1CN2CCC1CC2- InChIKey
ZWRQGIZWUWILND-UHFFFAOYSA-N- Molecular formula
- C15H25N3O
- Average molar mass
- 263.38 g/mol
- Monoisotopic mass
- 263.19976243
Names & identifiers
- Preferred name
- 3-(4-Pentyloxy-1H-pyrazol-3-yl)-1-azabicyclo[2.2.2]octane
- IUPAC
- 3-(4-pentoxy-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]octane
Names & synonyms
SCHEMBL2121836ZWRQGIZWUWILND-UHFFFAOYSA-N3-(4-Pentyloxy-1H-pyrazol-3-yl)-1-azabicyclo[2.2.2]octane
Database identifiers
- PubChem CID
- 25205548
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 41.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 279
Related reactions
3 records
Compound notes
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