Basic information
- Standard SMILES
COc1cc2c(CC(=O)N(C)Cc3ccccc3)cnc(CN)c2cc1OC- InChIKey
ULTGQUWSZXMSMU-UHFFFAOYSA-N- Molecular formula
- C22H25N3O3
- Average molar mass
- 379.5 g/mol
Names & identifiers
- Preferred name
- 2-[1-(aminomethyl)-6,7-dimethoxyisoquinolin-4-yl]-N-benzyl-N-methylacetamide
- IUPAC
- 2-[1-(aminomethyl)-6,7-dimethoxyisoquinolin-4-yl]-N-benzyl-N-methylacetamide
Names & synonyms
SCHEMBL3362127
Database identifiers
- PubChem CID
- 46847367
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 497
Related reactions
1 records
Compound notes
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