8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid

C17H17N3O5 — CID 86701152

IUPAC8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
SMILESCOCc1cc2c(cc1C(=O)O)[nH]c(=O)c1cnc(C3CCOC3)n12
InChIInChI=1S/C17H17N3O5/c1-24-7-10-4-13-12(5-11(10)17(22)23)19-16(21)14-6-18-15(20(13)14)9-2-3-25-8-9/h4-6,9H,2-3,7-8H2,1H3,(H,19,21)(H,22,23)
InChIKeyNORORXCBPUUZIH-UHFFFAOYSA-N
MW343.34 g/mol
LogP1.52
Rot. Bonds4

About 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid

8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid (PubChem CID 86701152) has the molecular formula C17H17N3O5 and a molecular weight of 343.34 g/mol. Its IUPAC name is 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid.

Molecular Properties

Compound Name8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
PubChem CID86701152
Molecular FormulaC17H17N3O5
Molecular Weight343.34 g/mol
Exact Mass343.12
IUPAC Name8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
SMILESCOCc1cc2c(cc1C(=O)O)[nH]c(=O)c1cnc(C3CCOC3)n12
InChIInChI=1S/C17H17N3O5/c1-24-7-10-4-13-12(5-11(10)17(22)23)19-16(21)14-6-18-15(20(13)14)9-2-3-25-8-9/h4-6,9H,2-3,7-8H2,1H3,(H,19,21)(H,22,23)
InChIKeyNORORXCBPUUZIH-UHFFFAOYSA-N
XLogP1.52
TPSA105.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.34
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-methyl-1-(oxan-3-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
CID 58574974
methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate
CID 58575132
8-methyl-7-(4-methyl-1,3-dihydroisoindole-2-carbonyl)-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575436
7-(6-methoxy-3,4-dihydro-2H-quinoline-1-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575017
6-[8-methyl-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carbonyl]-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridin-3-one
CID 58575395
8-cyclopropyl-7-(1,3-dihydroisoindole-2-carbonyl)-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one;hydrochloride
CID 157372122
7-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575011
7-(5-bromo-2,3-dihydroindole-1-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58574947
7-(5-chloro-1,3-dihydroisoindole-2-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 46910392
7-(7-fluoro-3,4-dihydro-1H-isoquinoline-2-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575009
7-[2-(hydroxymethyl)-2,3-dihydroindole-1-carbonyl]-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575147
7-(5-chloro-2,3-dihydroindole-1-carbonyl)-8-fluoro-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 56928918

Frequently Asked Questions

What is the IUPAC name of 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid?
The IUPAC name of 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid (CID 86701152) is 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid.
What is the SMILES notation for 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid?
The canonical SMILES for 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid is COCc1cc2c(cc1C(=O)O)[nH]c(=O)c1cnc(C3CCOC3)n12.
What is the InChIKey of 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid?
The InChIKey is NORORXCBPUUZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O5/c1-24-7-10-4-13-12(5-11(10)17(22)23)19-16(21)14-6-18-15(20(13)14)9-2-3-25-8-9/h4-6,9H,2-3,7-8H2,1H3,(H,19,21)(H,22,23).
What are the key properties of 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid?
8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid has a molecular weight of 343.34 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid is sourced from PubChem (CID 86701152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).