N,N,2,3-tetramethyl-4-[(E)-2-quinolin-4-ylethenyl]aniline
Basic information
- CAS
798-68-5- Standard SMILES
Cc1c(/C=C/c2ccnc3ccccc23)ccc(N(C)C)c1C- InChIKey
BOHNKFWQJRVQCE-MDZDMXLPSA-N- Molecular formula
- C21H22N2
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.17829871
Names & identifiers
- Preferred name
- N,N,2,3-tetramethyl-4-[(E)-2-quinolin-4-ylethenyl]aniline
- IUPAC
- N,N,2,3-tetramethyl-4-[(E)-2-quinolin-4-ylethenyl]aniline
Names & synonyms
798-68-5NSC409915CHEMBL1892692NSC409916NSC-409915NSC-409916NCGC00184117-01NCGC00184117-02NCGC00184117-03NCGC00184117-04NCGC00184117-05
Database identifiers
- CAS
798-68-5- PubChem CID
- 6301094
- ChEMBL
CHEMBL1892692
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 16.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 403
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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