Basic information
- Standard SMILES
Cc1cc(C2CN(C(=O)OC(C)(C)C)C2)c2ccccc2n1- InChIKey
UZRFQQVRHMBUIL-UHFFFAOYSA-N- Molecular formula
- C18H22N2O2
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.16812795
Names & identifiers
- Preferred name
- Tert-butyl 3-(2-methylquinolin-4-yl)azetidine-1-carboxylate
- IUPAC
- tert-butyl 3-(2-methylquinolin-4-yl)azetidine-1-carboxylate
Database identifiers
- PubChem CID
- 44239656
- Nikkaji
- J2.761.038B
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 412
Related reactions
1 records
Compound notes
Loading…