1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one

C13H13N3O — CID 15076567

IUPAC1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESCCc1nc(C)c2c(=O)[nH]c3ccccc3n12
InChIInChI=1S/C13H13N3O/c1-3-11-14-8(2)12-13(17)15-9-6-4-5-7-10(9)16(11)12/h4-7H,3H2,1-2H3,(H,15,17)
InChIKeyPBRFQQAUEOPPGQ-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.05
Rot. Bonds1

About 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one

1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one (PubChem CID 15076567) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one.

Molecular Properties

Compound Name1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one
PubChem CID15076567
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC Name1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESCCc1nc(C)c2c(=O)[nH]c3ccccc3n12
InChIInChI=1S/C13H13N3O/c1-3-11-14-8(2)12-13(17)15-9-6-4-5-7-10(9)16(11)12/h4-7H,3H2,1-2H3,(H,15,17)
InChIKeyPBRFQQAUEOPPGQ-UHFFFAOYSA-N
XLogP2.05
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenyl)-2,5-dimethyl-N-(6-methylpyridin-2-yl)-1H-imidazole-4-carboxamide
CID 71580330
2-ethyl-9-(2-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
CID 7599528
2-methyl-5H-imidazo[1,2-a]quinoxalin-4-one
CID 15076559
1-ethyl-8-imidazol-1-yl-5H-imidazo[1,5-a]quinoxalin-4-one
CID 15076571
1-ethyl-8-imidazol-1-yl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one
CID 15076572
1-ethyl-8-(2-ethyl-4-methylimidazol-1-yl)-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one
CID 15076573
1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one
CID 15076574
4H,5H-imidazo[1,5-a]quinoxalin-4-one
CID 15497845
N,N-diethyl-4-oxo-5H-imidazo[1,5-a]quinoxaline-3-carboxamide
CID 46903859
1-(4-fluorophenyl)-N-(6-fluoro-2-pyridinyl)-2,5-dimethylimidazole-4-carboxamide
CID 71580443
N-(5-fluoro-6-methyl-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide
CID 71717116
N-(6-cyano-2-pyridinyl)-1-(4-fluorophenyl)-2,5-dimethylimidazole-4-carboxamide
CID 71717735

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one?
The IUPAC name of 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one (CID 15076567) is 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one.
What is the SMILES notation for 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one?
The canonical SMILES for 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one is CCc1nc(C)c2c(=O)[nH]c3ccccc3n12.
What is the InChIKey of 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one?
The InChIKey is PBRFQQAUEOPPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-3-11-14-8(2)12-13(17)15-9-6-4-5-7-10(9)16(11)12/h4-7H,3H2,1-2H3,(H,15,17).
What are the key properties of 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one?
1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one has a molecular weight of 227.27 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-5H-imidazo[1,5-a]quinoxalin-4-one is sourced from PubChem (CID 15076567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).