Basic information
- Standard SMILES
COc1cc2c(cc1OC)C(C)N(C(=O)Cc1ccc(N)cc1)CC2- InChIKey
UVUSTEDRTJDKMI-UHFFFAOYSA-N- Molecular formula
- C20H24N2O3
- Average molar mass
- 340.4 g/mol
Names & identifiers
- Preferred name
- N-(4-aminophenylacetyl)-1,2,3,4-tetrahydro-6,7-dimethoxy-1-methylisoquinoline
- IUPAC
- 2-(4-aminophenyl)-1-(6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
Names & synonyms
SCHEMBL10661700UVUSTEDRTJDKMI-UHFFFAOYSA-NN-(4-aminophenylacetyl)-1,2,3,4-tetrahydro-6,7-dimethoxy-1-methylisoquinoline
Database identifiers
- PubChem CID
- 21295812
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 64.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 450
Related reactions
2 records
Compound notes
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