8-methoxy-1-methylisoquinolin-5-ol

C11H11NO2 — CID 115017702

IUPAC8-methoxy-1-methylisoquinolin-5-ol
SMILESCOc1ccc(O)c2ccnc(C)c12
InChIInChI=1S/C11H11NO2/c1-7-11-8(5-6-12-7)9(13)3-4-10(11)14-2/h3-6,13H,1-2H3
InChIKeyPIJHIUDMPOMBQX-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.26
Rot. Bonds1

About 8-methoxy-1-methylisoquinolin-5-ol

8-methoxy-1-methylisoquinolin-5-ol (PubChem CID 115017702) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 8-methoxy-1-methylisoquinolin-5-ol.

Molecular Properties

Compound Name8-methoxy-1-methylisoquinolin-5-ol
PubChem CID115017702
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name8-methoxy-1-methylisoquinolin-5-ol
SMILESCOc1ccc(O)c2ccnc(C)c12
InChIInChI=1S/C11H11NO2/c1-7-11-8(5-6-12-7)9(13)3-4-10(11)14-2/h3-6,13H,1-2H3
InChIKeyPIJHIUDMPOMBQX-UHFFFAOYSA-N
XLogP2.26
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-1-methylisoquinolin-5-ol?
The IUPAC name of 8-methoxy-1-methylisoquinolin-5-ol (CID 115017702) is 8-methoxy-1-methylisoquinolin-5-ol.
What is the SMILES notation for 8-methoxy-1-methylisoquinolin-5-ol?
The canonical SMILES for 8-methoxy-1-methylisoquinolin-5-ol is COc1ccc(O)c2ccnc(C)c12.
What is the InChIKey of 8-methoxy-1-methylisoquinolin-5-ol?
The InChIKey is PIJHIUDMPOMBQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-7-11-8(5-6-12-7)9(13)3-4-10(11)14-2/h3-6,13H,1-2H3.
What are the key properties of 8-methoxy-1-methylisoquinolin-5-ol?
8-methoxy-1-methylisoquinolin-5-ol has a molecular weight of 189.21 g/mol, XLogP of 2.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-1-methylisoquinolin-5-ol is sourced from PubChem (CID 115017702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).