5-methylcyclobuta[b]quinoxaline-1,2-diol

C11H8N2O2 — CID 135480968

IUPAC5-methylcyclobuta[b]quinoxaline-1,2-diol
SMILESCc1ccc2nc3c(nc2c1)C(O)=C3O
InChIInChI=1S/C11H8N2O2/c1-5-2-3-6-7(4-5)13-9-8(12-6)10(14)11(9)15/h2-4,14-15H,1H3
InChIKeyZOTPKQVWKWKXOJ-UHFFFAOYSA-N
MW200.20 g/mol
LogP2.19
Rot. Bonds

About 5-methylcyclobuta[b]quinoxaline-1,2-diol

5-methylcyclobuta[b]quinoxaline-1,2-diol (PubChem CID 135480968) has the molecular formula C11H8N2O2 and a molecular weight of 200.20 g/mol. Its IUPAC name is 5-methylcyclobuta[b]quinoxaline-1,2-diol.

Molecular Properties

Compound Name5-methylcyclobuta[b]quinoxaline-1,2-diol
PubChem CID135480968
Molecular FormulaC11H8N2O2
Molecular Weight200.20 g/mol
Exact Mass200.06
IUPAC Name5-methylcyclobuta[b]quinoxaline-1,2-diol
SMILESCc1ccc2nc3c(nc2c1)C(O)=C3O
InChIInChI=1S/C11H8N2O2/c1-5-2-3-6-7(4-5)13-9-8(12-6)10(14)11(9)15/h2-4,14-15H,1H3
InChIKeyZOTPKQVWKWKXOJ-UHFFFAOYSA-N
XLogP2.19
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-methylcyclobuta[b]quinoxaline-1,2-diol 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 5-methylcyclobuta[b]quinoxaline-1,2-diol?
The IUPAC name of 5-methylcyclobuta[b]quinoxaline-1,2-diol (CID 135480968) is 5-methylcyclobuta[b]quinoxaline-1,2-diol.
What is the SMILES notation for 5-methylcyclobuta[b]quinoxaline-1,2-diol?
The canonical SMILES for 5-methylcyclobuta[b]quinoxaline-1,2-diol is Cc1ccc2nc3c(nc2c1)C(O)=C3O.
What is the InChIKey of 5-methylcyclobuta[b]quinoxaline-1,2-diol?
The InChIKey is ZOTPKQVWKWKXOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O2/c1-5-2-3-6-7(4-5)13-9-8(12-6)10(14)11(9)15/h2-4,14-15H,1H3.
What are the key properties of 5-methylcyclobuta[b]quinoxaline-1,2-diol?
5-methylcyclobuta[b]quinoxaline-1,2-diol has a molecular weight of 200.20 g/mol, XLogP of 2.19, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylcyclobuta[b]quinoxaline-1,2-diol is sourced from PubChem (CID 135480968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).