6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline

C23H19N5O — CID 127038509

IUPAC6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline
SMILESCOc1cc(-c2cccnc2)cc2c1nc(C)c1c(C)nc(-c3cccnc3)n12
InChIInChI=1S/C23H19N5O/c1-14-22-15(2)27-23(17-7-5-9-25-13-17)28(22)19-10-18(16-6-4-8-24-12-16)11-20(29-3)21(19)26-14/h4-13H,1-3H3
InChIKeyJOJOWCOCCMULDU-UHFFFAOYSA-N
MW381.44 g/mol
LogP4.63
Rot. Bonds3

About 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline

6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline (PubChem CID 127038509) has the molecular formula C23H19N5O and a molecular weight of 381.44 g/mol. Its IUPAC name is 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline.

Molecular Properties

Compound Name6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline
PubChem CID127038509
Molecular FormulaC23H19N5O
Molecular Weight381.44 g/mol
Exact Mass381.16
IUPAC Name6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline
SMILESCOc1cc(-c2cccnc2)cc2c1nc(C)c1c(C)nc(-c3cccnc3)n12
InChIInChI=1S/C23H19N5O/c1-14-22-15(2)27-23(17-7-5-9-25-13-17)28(22)19-10-18(16-6-4-8-24-12-16)11-20(29-3)21(19)26-14/h4-13H,1-3H3
InChIKeyJOJOWCOCCMULDU-UHFFFAOYSA-N
XLogP4.63
TPSA65.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline?
The IUPAC name of 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline (CID 127038509) is 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline.
What is the SMILES notation for 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline?
The canonical SMILES for 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline is COc1cc(-c2cccnc2)cc2c1nc(C)c1c(C)nc(-c3cccnc3)n12.
What is the InChIKey of 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline?
The InChIKey is JOJOWCOCCMULDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N5O/c1-14-22-15(2)27-23(17-7-5-9-25-13-17)28(22)19-10-18(16-6-4-8-24-12-16)11-20(29-3)21(19)26-14/h4-13H,1-3H3.
What are the key properties of 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline?
6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline has a molecular weight of 381.44 g/mol, XLogP of 4.63, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3,4-dimethyl-1,8-dipyridin-3-ylimidazo[1,5-a]quinoxaline is sourced from PubChem (CID 127038509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).