Basic information
- Standard SMILES
COc1cc2c(c(O)c1OC)C(C)N(C)CC2- InChIKey
NKHMWHLJHODBEP-UHFFFAOYSA-N- Molecular formula
- C13H19NO3
- Average molar mass
- 237.29 g/mol
- Monoisotopic mass
- 237.13649347
Names & identifiers
- Preferred name
- 6,7-dimethoxy-1,2-dimethyl-3,4-dihydro-1H-isoquinolin-8-ol
- IUPAC
- 6,7-dimethoxy-1,2-dimethyl-3,4-dihydro-1H-isoquinolin-8-ol
Names & synonyms
Methylanhalonidine(+/-)-Pellotine (hydrochloride)6,7-dimethoxy-1,2-dimethyl-3,4-dihydro-1H-isoquinolin-8-ol26126-01-2(?)-Pellotine (hydrochloride)orb2942892CHEMBL5195212SCHEMBL25374841DTXSID50871560NKHMWHLJHODBEP-UHFFFAOYSA-NTN9164HY-170908
Show more names
Q154252906,7-Dimethoxy-1,2-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol19622-05-0
Database identifiers
- PubChem CID
- 65742
- DTXSID
DTXSID50871560- ChEMBL
CHEMBL5195212
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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