quinazolin-6-ol

C8H6N2O — CID 589643

IUPACquinazolin-6-ol
SMILESOc1ccc2ncncc2c1
InChIInChI=1S/C8H6N2O/c11-7-1-2-8-6(3-7)4-9-5-10-8/h1-5,11H
InChIKeyBBPMVEXRMOAIKQ-UHFFFAOYSA-N
MW146.15 g/mol
LogP1.34
Rot. Bonds

About quinazolin-6-ol

quinazolin-6-ol (PubChem CID 589643) has the molecular formula C8H6N2O and a molecular weight of 146.15 g/mol. Its IUPAC name is quinazolin-6-ol.

Molecular Properties

Compound Namequinazolin-6-ol
PubChem CID589643
Molecular FormulaC8H6N2O
Molecular Weight146.15 g/mol
Exact Mass146.05
IUPAC Namequinazolin-6-ol
SMILESOc1ccc2ncncc2c1
InChIInChI=1S/C8H6N2O/c11-7-1-2-8-6(3-7)4-9-5-10-8/h1-5,11H
InChIKeyBBPMVEXRMOAIKQ-UHFFFAOYSA-N
XLogP1.34
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze quinazolin-6-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of quinazolin-6-ol?
The IUPAC name of quinazolin-6-ol (CID 589643) is quinazolin-6-ol.
What is the SMILES notation for quinazolin-6-ol?
The canonical SMILES for quinazolin-6-ol is Oc1ccc2ncncc2c1.
What is the InChIKey of quinazolin-6-ol?
The InChIKey is BBPMVEXRMOAIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O/c11-7-1-2-8-6(3-7)4-9-5-10-8/h1-5,11H.
What are the key properties of quinazolin-6-ol?
quinazolin-6-ol has a molecular weight of 146.15 g/mol, XLogP of 1.34, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for quinazolin-6-ol is sourced from PubChem (CID 589643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).