1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one

C17H20N4O2 — CID 15076574

IUPAC1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESCCc1nc(C)c2c(=O)[nH]c3ccc(N4CCOCC4)cc3n12
InChIInChI=1S/C17H20N4O2/c1-3-15-18-11(2)16-17(22)19-13-5-4-12(10-14(13)21(15)16)20-6-8-23-9-7-20/h4-5,10H,3,6-9H2,1-2H3,(H,19,22)
InChIKeyAXUAHHNAODQHNX-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.88
Rot. Bonds2

About 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one

1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one (PubChem CID 15076574) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one.

Molecular Properties

Compound Name1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one
PubChem CID15076574
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESCCc1nc(C)c2c(=O)[nH]c3ccc(N4CCOCC4)cc3n12
InChIInChI=1S/C17H20N4O2/c1-3-15-18-11(2)16-17(22)19-13-5-4-12(10-14(13)21(15)16)20-6-8-23-9-7-20/h4-5,10H,3,6-9H2,1-2H3,(H,19,22)
InChIKeyAXUAHHNAODQHNX-UHFFFAOYSA-N
XLogP1.88
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one?
The IUPAC name of 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one (CID 15076574) is 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one.
What is the SMILES notation for 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one?
The canonical SMILES for 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one is CCc1nc(C)c2c(=O)[nH]c3ccc(N4CCOCC4)cc3n12.
What is the InChIKey of 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one?
The InChIKey is AXUAHHNAODQHNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-3-15-18-11(2)16-17(22)19-13-5-4-12(10-14(13)21(15)16)20-6-8-23-9-7-20/h4-5,10H,3,6-9H2,1-2H3,(H,19,22).
What are the key properties of 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one?
1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one has a molecular weight of 312.37 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methyl-8-morpholin-4-yl-5H-imidazo[1,5-a]quinoxalin-4-one is sourced from PubChem (CID 15076574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).