isoquinolin-8-ol

C9H7NO — CID 135441711

IUPACisoquinolin-8-ol
SMILESOc1cccc2ccncc12
InChIInChI=1S/C9H7NO/c11-9-3-1-2-7-4-5-10-6-8(7)9/h1-6,11H
InChIKeyZIXWTPREILQLAC-UHFFFAOYSA-N
MW145.16 g/mol
LogP1.94
Rot. Bonds

About isoquinolin-8-ol

isoquinolin-8-ol (PubChem CID 135441711) has the molecular formula C9H7NO and a molecular weight of 145.16 g/mol. Its IUPAC name is isoquinolin-8-ol.

Molecular Properties

Compound Nameisoquinolin-8-ol
PubChem CID135441711
Molecular FormulaC9H7NO
Molecular Weight145.16 g/mol
Exact Mass145.05
IUPAC Nameisoquinolin-8-ol
SMILESOc1cccc2ccncc12
InChIInChI=1S/C9H7NO/c11-9-3-1-2-7-4-5-10-6-8(7)9/h1-6,11H
InChIKeyZIXWTPREILQLAC-UHFFFAOYSA-N
XLogP1.94
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

isoquinolin-8-ylmethanamine;dihydrochloride
CID 42614394
2,9-phenanthroline
CID 23271029
4-isoquinolin-8-ylbutan-2-one
CID 103144158
isoquinoline-8-carboxylate
CID 86306452
3-isoquinolin-8-ylpentan-3-ol
CID 103142702
naphthalen-1-ol;pyridine
CID 160876082
S-isoquinolin-8-ylthiohydroxylamine
CID 145138115
8-aminoisoquinolin-7-ol;hydrochloride
CID 67670050
1-isoquinolin-8-ylpentan-3-one
CID 103144159
bis(naphthalen-1-ol);titanium(2+);dichloride
CID 21243627
bis(naphthalen-1-ol);zirconium(2+);dichloride
CID 21243616
2,2-difluoro-1-isoquinolin-8-ylethanone
CID 103143371

Frequently Asked Questions

What is the IUPAC name of isoquinolin-8-ol?
The IUPAC name of isoquinolin-8-ol (CID 135441711) is isoquinolin-8-ol.
What is the SMILES notation for isoquinolin-8-ol?
The canonical SMILES for isoquinolin-8-ol is Oc1cccc2ccncc12.
What is the InChIKey of isoquinolin-8-ol?
The InChIKey is ZIXWTPREILQLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO/c11-9-3-1-2-7-4-5-10-6-8(7)9/h1-6,11H.
What are the key properties of isoquinolin-8-ol?
isoquinolin-8-ol has a molecular weight of 145.16 g/mol, XLogP of 1.94, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for isoquinolin-8-ol is sourced from PubChem (CID 135441711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).