4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one

C15H11N5O2 — CID 11335341

IUPAC4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one
SMILESNc1nc2ccccc2n2c(=O)n(-c3ccc(O)cc3)nc12
InChIInChI=1S/C15H11N5O2/c16-13-14-18-20(9-5-7-10(21)8-6-9)15(22)19(14)12-4-2-1-3-11(12)17-13/h1-8,21H,(H2,16,17)
InChIKeyICVXFAOHTPSOBT-UHFFFAOYSA-N
MW293.29 g/mol
LogP1.32
Rot. Bonds1

About 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one

4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one (PubChem CID 11335341) has the molecular formula C15H11N5O2 and a molecular weight of 293.29 g/mol. Its IUPAC name is 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one.

Molecular Properties

Compound Name4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one
PubChem CID11335341
Molecular FormulaC15H11N5O2
Molecular Weight293.29 g/mol
Exact Mass293.09
IUPAC Name4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one
SMILESNc1nc2ccccc2n2c(=O)n(-c3ccc(O)cc3)nc12
InChIInChI=1S/C15H11N5O2/c16-13-14-18-20(9-5-7-10(21)8-6-9)15(22)19(14)12-4-2-1-3-11(12)17-13/h1-8,21H,(H2,16,17)
InChIKeyICVXFAOHTPSOBT-UHFFFAOYSA-N
XLogP1.32
TPSA98.44 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.29
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one 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 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one?
The IUPAC name of 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one (CID 11335341) is 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one.
What is the SMILES notation for 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one?
The canonical SMILES for 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one is Nc1nc2ccccc2n2c(=O)n(-c3ccc(O)cc3)nc12.
What is the InChIKey of 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one?
The InChIKey is ICVXFAOHTPSOBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5O2/c16-13-14-18-20(9-5-7-10(21)8-6-9)15(22)19(14)12-4-2-1-3-11(12)17-13/h1-8,21H,(H2,16,17).
What are the key properties of 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one?
4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one has a molecular weight of 293.29 g/mol, XLogP of 1.32, 1 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(4-hydroxyphenyl)-[1,2,4]triazolo[4,3-a]quinoxalin-1-one is sourced from PubChem (CID 11335341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).