N-(2-((3-Cyano-6-methylquinolin-2-yl)amino)ethyl)-3,4-dimethoxybenzamide
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Basic information
- CAS
606105-54-8- Standard SMILES
COc1ccc(C(=O)NCCNc2nc3ccc(C)cc3cc2C#N)cc1OC- InChIKey
AYYIGRQBAFQJNP-UHFFFAOYSA-N- Molecular formula
- C22H22N4O3
- Average molar mass
- 390.4 g/mol
- Monoisotopic mass
- 390.16919058
Names & identifiers
- Preferred name
- N-(2-((3-Cyano-6-methylquinolin-2-yl)amino)ethyl)-3,4-dimethoxybenzamide
- IUPAC
- N-[2-[(3-cyano-6-methylquinolin-2-yl)amino]ethyl]-3,4-dimethoxybenzamide
- English name
- Benzamide, N-[2-[(3-cyano-6-methyl-2-quinolinyl)amino]ethyl]-3,4-dimethoxy- (9CI)
- Molecular formula
- C22H22N4O3
- Molecular weight
- 390.44
Names & synonyms
606105-54-8ASN 06146861N-(2-((3-Cyano-6-methylquinolin-2-yl)amino)ethyl)-3,4-dimethoxybenzamideCHEMBL1403454N-[2-[(3-cyano-6-methylquinolin-2-yl)amino]ethyl]-3,4-dimethoxybenzamideN-{2-[(3-CYANO-6-METHYLQUINOLIN-2-YL)AMINO]ETHYL}-3,4-DIMETHOXYBENZAMIDEMLS001212847SCHEMBL14235628DTXSID50390443HMS2838E12BDBM50516901AKOS000765357
Show more names
Benzamide, N-[2-[(3-cyano-6-methyl-2-quinolinyl)amino]ethyl]-3,4-dimethoxy-Benzamide, N-[2-[(3-cyano-6-methyl-2-quinolinyl)amino]ethyl]-3,4-dimethoxy- (9CI)
N-[2-(3-Cyano-6-methyl-quinolin-2-ylamino)-ethyl]-3,4-dimethoxy-benzamideSMR000503709SR-01000341403SR-01000341403-1
Database identifiers
- CAS
606105-54-8- PubChem CID
- 3217032
- DTXSID
DTXSID50390443- ChEMBL
CHEMBL1403454
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 96.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 592
Related reactions
0 records
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Compound notes
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