6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol

C11H13NO3 — CID 91665418

IUPAC6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol
SMILESCOc1cc2c(c(OC)c1O)C=NCC2
InChIInChI=1S/C11H13NO3/c1-14-9-5-7-3-4-12-6-8(7)11(15-2)10(9)13/h5-6,13H,3-4H2,1-2H3
InChIKeyGDGPJRRVPAZIQX-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.38
Rot. Bonds2

About 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol

6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol (PubChem CID 91665418) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol.

Molecular Properties

Compound Name6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol
PubChem CID91665418
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol
SMILESCOc1cc2c(c(OC)c1O)C=NCC2
InChIInChI=1S/C11H13NO3/c1-14-9-5-7-3-4-12-6-8(7)11(15-2)10(9)13/h5-6,13H,3-4H2,1-2H3
InChIKeyGDGPJRRVPAZIQX-UHFFFAOYSA-N
XLogP1.38
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol?
The IUPAC name of 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol (CID 91665418) is 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol.
What is the SMILES notation for 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol?
The canonical SMILES for 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol is COc1cc2c(c(OC)c1O)C=NCC2.
What is the InChIKey of 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol?
The InChIKey is GDGPJRRVPAZIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-14-9-5-7-3-4-12-6-8(7)11(15-2)10(9)13/h5-6,13H,3-4H2,1-2H3.
What are the key properties of 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol?
6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol has a molecular weight of 207.23 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethoxy-3,4-dihydroisoquinolin-7-ol is sourced from PubChem (CID 91665418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).