Basic information
- Standard SMILES
CC(C)(C)C(=O)NC1CCN(c2ccc3cc(C#N)ccc3n2)C1- InChIKey
UXUBKPCLCQGEGC-UHFFFAOYSA-N- Molecular formula
- C19H22N4O
- Average molar mass
- 322.4 g/mol
- Monoisotopic mass
- 322.17936134
Names & identifiers
- Preferred name
- N-[1-(6-cyanoquinolin-2-yl)pyrrolidin-3-yl]-2,2-dimethylpropanamide
- IUPAC
- N-[1-(6-cyanoquinolin-2-yl)pyrrolidin-3-yl]-2,2-dimethylpropanamide
Names & synonyms
SCHEMBL5873627UXUBKPCLCQGEGC-UHFFFAOYSA-NN-[1-(6-cyanoquinolin-2-yl)pyrrolidin-3-yl]-2,2-dimethylpropanamide
Database identifiers
- PubChem CID
- 22018989
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 69 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 517
Related reactions
3 records
Compound notes
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