2-methylquinoxalin-5-ol

C9H8N2O — CID 135546994

IUPAC2-methylquinoxalin-5-ol
SMILESCc1cnc2c(O)cccc2n1
InChIInChI=1S/C9H8N2O/c1-6-5-10-9-7(11-6)3-2-4-8(9)12/h2-5,12H,1H3
InChIKeyISMGVCMJDUISJW-UHFFFAOYSA-N
MW160.18 g/mol
LogP1.64
Rot. Bonds

About 2-methylquinoxalin-5-ol

2-methylquinoxalin-5-ol (PubChem CID 135546994) has the molecular formula C9H8N2O and a molecular weight of 160.18 g/mol. Its IUPAC name is 2-methylquinoxalin-5-ol.

Molecular Properties

Compound Name2-methylquinoxalin-5-ol
PubChem CID135546994
Molecular FormulaC9H8N2O
Molecular Weight160.18 g/mol
Exact Mass160.06
IUPAC Name2-methylquinoxalin-5-ol
SMILESCc1cnc2c(O)cccc2n1
InChIInChI=1S/C9H8N2O/c1-6-5-10-9-7(11-6)3-2-4-8(9)12/h2-5,12H,1H3
InChIKeyISMGVCMJDUISJW-UHFFFAOYSA-N
XLogP1.64
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methylquinoxalin-5-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 2-methylquinoxalin-5-ol?
The IUPAC name of 2-methylquinoxalin-5-ol (CID 135546994) is 2-methylquinoxalin-5-ol.
What is the SMILES notation for 2-methylquinoxalin-5-ol?
The canonical SMILES for 2-methylquinoxalin-5-ol is Cc1cnc2c(O)cccc2n1.
What is the InChIKey of 2-methylquinoxalin-5-ol?
The InChIKey is ISMGVCMJDUISJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O/c1-6-5-10-9-7(11-6)3-2-4-8(9)12/h2-5,12H,1H3.
What are the key properties of 2-methylquinoxalin-5-ol?
2-methylquinoxalin-5-ol has a molecular weight of 160.18 g/mol, XLogP of 1.64, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylquinoxalin-5-ol is sourced from PubChem (CID 135546994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).