2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline

C18H15N5O — CID 90346229

IUPAC2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline
SMILESCOc1nc2ccccc2nc1-c1nn(C)nc1-c1ccccc1
InChIInChI=1S/C18H15N5O/c1-23-21-15(12-8-4-3-5-9-12)16(22-23)17-18(24-2)20-14-11-7-6-10-13(14)19-17/h3-11H,1-2H3
InChIKeyDRWMASARFLZVFV-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.10
Rot. Bonds3

About 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline

2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline (PubChem CID 90346229) has the molecular formula C18H15N5O and a molecular weight of 317.35 g/mol. Its IUPAC name is 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline.

Molecular Properties

Compound Name2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline
PubChem CID90346229
Molecular FormulaC18H15N5O
Molecular Weight317.35 g/mol
Exact Mass317.13
IUPAC Name2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline
SMILESCOc1nc2ccccc2nc1-c1nn(C)nc1-c1ccccc1
InChIInChI=1S/C18H15N5O/c1-23-21-15(12-8-4-3-5-9-12)16(22-23)17-18(24-2)20-14-11-7-6-10-13(14)19-17/h3-11H,1-2H3
InChIKeyDRWMASARFLZVFV-UHFFFAOYSA-N
XLogP3.10
TPSA65.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline 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-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline?
The IUPAC name of 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline (CID 90346229) is 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline.
What is the SMILES notation for 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline?
The canonical SMILES for 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline is COc1nc2ccccc2nc1-c1nn(C)nc1-c1ccccc1.
What is the InChIKey of 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline?
The InChIKey is DRWMASARFLZVFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O/c1-23-21-15(12-8-4-3-5-9-12)16(22-23)17-18(24-2)20-14-11-7-6-10-13(14)19-17/h3-11H,1-2H3.
What are the key properties of 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline?
2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline has a molecular weight of 317.35 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-(2-methyl-5-phenyltriazol-4-yl)quinoxaline is sourced from PubChem (CID 90346229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).