8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline

C19H16ClN3 — CID 42629951

IUPAC8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline
SMILESCc1ccccc1-c1nc(C)c2c(C)nc3ccc(Cl)cc3n12
InChIInChI=1S/C19H16ClN3/c1-11-6-4-5-7-15(11)19-22-13(3)18-12(2)21-16-9-8-14(20)10-17(16)23(18)19/h4-10H,1-3H3
InChIKeyYKDZLWKXZOOQGO-UHFFFAOYSA-N
MW321.81 g/mol
LogP5.13
Rot. Bonds1

About 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline

8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline (PubChem CID 42629951) has the molecular formula C19H16ClN3 and a molecular weight of 321.81 g/mol. Its IUPAC name is 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline.

Molecular Properties

Compound Name8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline
PubChem CID42629951
Molecular FormulaC19H16ClN3
Molecular Weight321.81 g/mol
Exact Mass321.10
IUPAC Name8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline
SMILESCc1ccccc1-c1nc(C)c2c(C)nc3ccc(Cl)cc3n12
InChIInChI=1S/C19H16ClN3/c1-11-6-4-5-7-15(11)19-22-13(3)18-12(2)21-16-9-8-14(20)10-17(16)23(18)19/h4-10H,1-3H3
InChIKeyYKDZLWKXZOOQGO-UHFFFAOYSA-N
XLogP5.13
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.81
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]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 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline?
The IUPAC name of 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline (CID 42629951) is 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline.
What is the SMILES notation for 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline?
The canonical SMILES for 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline is Cc1ccccc1-c1nc(C)c2c(C)nc3ccc(Cl)cc3n12.
What is the InChIKey of 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline?
The InChIKey is YKDZLWKXZOOQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3/c1-11-6-4-5-7-15(11)19-22-13(3)18-12(2)21-16-9-8-14(20)10-17(16)23(18)19/h4-10H,1-3H3.
What are the key properties of 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline?
8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline has a molecular weight of 321.81 g/mol, XLogP of 5.13, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline is sourced from PubChem (CID 42629951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).