3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline

C18H16N4 — CID 56648764

IUPAC3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline
SMILESCc1ccncc1-c1nc(C)c2c(C)nc3ccccc3n12
InChIInChI=1S/C18H16N4/c1-11-8-9-19-10-14(11)18-21-13(3)17-12(2)20-15-6-4-5-7-16(15)22(17)18/h4-10H,1-3H3
InChIKeyPYGVXOGEKPDRFE-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.87
Rot. Bonds1

About 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline

3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline (PubChem CID 56648764) has the molecular formula C18H16N4 and a molecular weight of 288.35 g/mol. Its IUPAC name is 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline.

Molecular Properties

Compound Name3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline
PubChem CID56648764
Molecular FormulaC18H16N4
Molecular Weight288.35 g/mol
Exact Mass288.14
IUPAC Name3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline
SMILESCc1ccncc1-c1nc(C)c2c(C)nc3ccccc3n12
InChIInChI=1S/C18H16N4/c1-11-8-9-19-10-14(11)18-21-13(3)17-12(2)20-15-6-4-5-7-16(15)22(17)18/h4-10H,1-3H3
InChIKeyPYGVXOGEKPDRFE-UHFFFAOYSA-N
XLogP3.87
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline?
The IUPAC name of 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline (CID 56648764) is 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline.
What is the SMILES notation for 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline?
The canonical SMILES for 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline is Cc1ccncc1-c1nc(C)c2c(C)nc3ccccc3n12.
What is the InChIKey of 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline?
The InChIKey is PYGVXOGEKPDRFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4/c1-11-8-9-19-10-14(11)18-21-13(3)17-12(2)20-15-6-4-5-7-16(15)22(17)18/h4-10H,1-3H3.
What are the key properties of 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline?
3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline has a molecular weight of 288.35 g/mol, XLogP of 3.87, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-1-(4-methyl-3-pyridinyl)imidazo[1,5-a]quinoxaline is sourced from PubChem (CID 56648764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).