8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one

C16H19N3O2 — CID 141205821

IUPAC8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESCCC(CC)c1ncc2c(=O)[nH]c3ccc(OC)cc3n12
InChIInChI=1S/C16H19N3O2/c1-4-10(5-2)15-17-9-14-16(20)18-12-7-6-11(21-3)8-13(12)19(14)15/h6-10H,4-5H2,1-3H3,(H,18,20)
InChIKeyHFJLIRORLOPMSZ-UHFFFAOYSA-N
MW285.35 g/mol
LogP3.09
Rot. Bonds4

About 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one

8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one (PubChem CID 141205821) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one.

Molecular Properties

Compound Name8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one
PubChem CID141205821
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESCCC(CC)c1ncc2c(=O)[nH]c3ccc(OC)cc3n12
InChIInChI=1S/C16H19N3O2/c1-4-10(5-2)15-17-9-14-16(20)18-12-7-6-11(21-3)8-13(12)19(14)15/h6-10H,4-5H2,1-3H3,(H,18,20)
InChIKeyHFJLIRORLOPMSZ-UHFFFAOYSA-N
XLogP3.09
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

9-(3-methoxyphenyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
CID 3936354
N-(4-methoxyphenyl)-3-phenylimidazole-4-carboxamide
CID 9267164
6-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-N-(3-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 44516301
4-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-7-methoxy-1,3-dihydroquinoxalin-2-one
CID 164610962
1-amino-N-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazole-3-carboxamide
CID 168272400
N-(3-methoxyphenyl)-1H-imidazole-4-carboxamide
CID 5299203
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 645754
2-Methyl-imidazo[1,2-a]pyridine-3-carboxylic acid (2,3-dihydro-benzo[1,4]dioxin-6-yl)-amide
CID 1172201
2-(3,7-dibenzyl-2,6-dioxopurin-1-yl)-N-(3-methoxyphenyl)acetamide
CID 3976160
8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-3-methyl-7-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
CID 4912077
2-(4-methoxyphenyl)-5H-imidazo[1,2-a]quinoxalin-4-one
CID 10266273
1-methyl-4-(pyridin-4-ylmethylamino)-N-(4-(trifluoromethoxy)phenyl)-1H-imidazole-5-carboxamide
CID 44439361

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one?
The IUPAC name of 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one (CID 141205821) is 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one.
What is the SMILES notation for 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one?
The canonical SMILES for 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one is CCC(CC)c1ncc2c(=O)[nH]c3ccc(OC)cc3n12.
What is the InChIKey of 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one?
The InChIKey is HFJLIRORLOPMSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-4-10(5-2)15-17-9-14-16(20)18-12-7-6-11(21-3)8-13(12)19(14)15/h6-10H,4-5H2,1-3H3,(H,18,20).
What are the key properties of 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one?
8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one has a molecular weight of 285.35 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-1-pentan-3-yl-5H-imidazo[1,5-a]quinoxalin-4-one is sourced from PubChem (CID 141205821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).