Basic information
- Standard SMILES
O=C(NC1CN2CCC1CC2)c1ccc2cccnc2c1- InChIKey
JWGIESDNNZMZSC-UHFFFAOYSA-N- Molecular formula
- C17H19N3O
- Average molar mass
- 281.35 g/mol
- Monoisotopic mass
- 281.15281224
Names & identifiers
- Preferred name
- N-(1-azabicyclo[2.2.2]octan-3-yl)quinoline-7-carboxamide
- IUPAC
- N-(1-azabicyclo[2.2.2]octan-3-yl)quinoline-7-carboxamide
Names & synonyms
CHEMBL3765305SCHEMBL1459330CHEMBL3765926BDBM50147162
Database identifiers
- PubChem CID
- 12985342
- ChEMBL
CHEMBL3765305、CHEMBL3765926
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 391
Related reactions
1 records
Compound notes
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