Basic information
- CAS
35690-53-0- Standard SMILES
COc1cc2c(cc1OC)CN(Cc1cc(C)ccc1N)CC2- InChIKey
FLCIKOUZKLRUHG-UHFFFAOYSA-N- Molecular formula
- C19H24N2O2
- Average molar mass
- 312.4 g/mol
- Monoisotopic mass
- 312.18377801
Names & identifiers
- Preferred name
- Benzenamine, 2-((3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)methyl)-4-methyl-
- IUPAC
- 2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-methylaniline
Names & synonyms
2-((3,4-Dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)methyl)-4-methylbenzenamine35690-53-0Benzenamine, 2-((3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)methyl)-4-methyl-N-(2'-Amino-5'-methyl benzyl) 6,7-dimethoxy 1,2,3,4-tetrahydroisoquinoleine [French]N-(2'-Amino-5'-methyl benzyl) 6,7-dimethoxy 1,2,3,4-tetrahydroisoquinoleineRefChem:3227742-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1h)-yl)methyl]-4-methylanilineDTXSID10957091
Database identifiers
- CAS
35690-53-0- PubChem CID
- 215435
- DTXSID
DTXSID10957091
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 47.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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