1-(4-Fluoro-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-isoquinoline

HCID 37411
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Basic information

Standard SMILES
COc1cc2c(cc1OC)C(Cc1ccc(F)cc1)NCC2
InChIKey
IGWXUFJDUPHOHK-UHFFFAOYSA-N
Molecular formula
C18H20FNO2
Average molar mass
301.4 g/mol

Names & identifiers

Preferred name
1-(4-Fluoro-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-isoquinoline
IUPAC
1-[(4-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Names & synonyms

1-(4-fluoro-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-isoquinolineSCHEMBL4029928IGWXUFJDUPHOHK-UHFFFAOYSA-N159899-90-8DB-3285721-(4-Fluoro-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline1-(4-fluorobenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-isoquinoline

Database identifiers

PubChem CID
37411
Nikkaji
J620.664F

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
30.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
22

Related reactions

5 records
New reaction record

Compound notes

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1-(4-Fluoro-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-isoquinoline (HCID 37411)｜Huagongshe