1-(dimethylamino)isoquinolin-8-ol

C11H12N2O — CID 136693438

IUPAC1-(dimethylamino)isoquinolin-8-ol
SMILESCN(C)c1nccc2cccc(O)c12
InChIInChI=1S/C11H12N2O/c1-13(2)11-10-8(6-7-12-11)4-3-5-9(10)14/h3-7,14H,1-2H3
InChIKeyOWQDSWLGHXBLIW-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.01
Rot. Bonds1

About 1-(dimethylamino)isoquinolin-8-ol

1-(dimethylamino)isoquinolin-8-ol (PubChem CID 136693438) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-(dimethylamino)isoquinolin-8-ol.

Molecular Properties

Compound Name1-(dimethylamino)isoquinolin-8-ol
PubChem CID136693438
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name1-(dimethylamino)isoquinolin-8-ol
SMILESCN(C)c1nccc2cccc(O)c12
InChIInChI=1S/C11H12N2O/c1-13(2)11-10-8(6-7-12-11)4-3-5-9(10)14/h3-7,14H,1-2H3
InChIKeyOWQDSWLGHXBLIW-UHFFFAOYSA-N
XLogP2.01
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)isoquinolin-8-ol?
The IUPAC name of 1-(dimethylamino)isoquinolin-8-ol (CID 136693438) is 1-(dimethylamino)isoquinolin-8-ol.
What is the SMILES notation for 1-(dimethylamino)isoquinolin-8-ol?
The canonical SMILES for 1-(dimethylamino)isoquinolin-8-ol is CN(C)c1nccc2cccc(O)c12.
What is the InChIKey of 1-(dimethylamino)isoquinolin-8-ol?
The InChIKey is OWQDSWLGHXBLIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-13(2)11-10-8(6-7-12-11)4-3-5-9(10)14/h3-7,14H,1-2H3.
What are the key properties of 1-(dimethylamino)isoquinolin-8-ol?
1-(dimethylamino)isoquinolin-8-ol has a molecular weight of 188.23 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)isoquinolin-8-ol is sourced from PubChem (CID 136693438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).