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

C17H13N3O — CID 11369390

IUPAC1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESCc1nc(-c2ccccc2)c2c(=O)[nH]c3ccccc3n12
InChIInChI=1S/C17H13N3O/c1-11-18-15(12-7-3-2-4-8-12)16-17(21)19-13-9-5-6-10-14(13)20(11)16/h2-10H,1H3,(H,19,21)
InChIKeyIMRFDWGUWVNDGG-UHFFFAOYSA-N
MW275.31 g/mol
LogP3.15
Rot. Bonds1

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

1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one (PubChem CID 11369390) has the molecular formula C17H13N3O and a molecular weight of 275.31 g/mol. Its IUPAC name is 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one.

Molecular Properties

Compound Name1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one
PubChem CID11369390
Molecular FormulaC17H13N3O
Molecular Weight275.31 g/mol
Exact Mass275.11
IUPAC Name1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESCc1nc(-c2ccccc2)c2c(=O)[nH]c3ccccc3n12
InChIInChI=1S/C17H13N3O/c1-11-18-15(12-7-3-2-4-8-12)16-17(21)19-13-9-5-6-10-14(13)20(11)16/h2-10H,1H3,(H,19,21)
InChIKeyIMRFDWGUWVNDGG-UHFFFAOYSA-N
XLogP3.15
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4H-Imidazo(4,5-c)quinolin-4-one, 1,5-dihydro-5-butyl-1-methyl-
CID 3077017
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-ethyl-5-phenyl-
CID 3071939
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-methyl-5-phenyl-
CID 3071959
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-5-phenyl-3-propyl-
CID 3071969
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-(2-methylpropyl)-5-phenyl-
CID 3071971
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-(1-methylethyl)-5-phenyl-
CID 3071940
5H-spiro[benzimidazo[1,2-c]quinazoline-6,3'-indol]-2'(1'H)-one
CID 2969089
6-(1H-benzimidazol-2-ylmethyl)-12H-quinoxalino[2,3-b][1,4]benzodiazepin-13-one
CID 71450627
6-[(1-allylbenzimidazol-2-yl)methyl]-12H-quinoxalino[2,3-b][1,4]benzodiazepin-13-one
CID 71452463
Pyrido[2',1':2,3]imidazo[4,5-c]quinolin-6(5H)-one
CID 616556
N-(1-propyl-1H-1,3-benzodiazol-2-yl)quinoline-2-carboxamide
CID 17399080
N-(1-methyl-1H-benzimidazol-2-yl)-2-[(phenylcarbonyl)amino]benzamide
CID 3824432

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one?
The IUPAC name of 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one (CID 11369390) is 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one.
What is the SMILES notation for 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one?
The canonical SMILES for 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one is Cc1nc(-c2ccccc2)c2c(=O)[nH]c3ccccc3n12.
What is the InChIKey of 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one?
The InChIKey is IMRFDWGUWVNDGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O/c1-11-18-15(12-7-3-2-4-8-12)16-17(21)19-13-9-5-6-10-14(13)20(11)16/h2-10H,1H3,(H,19,21).
What are the key properties of 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one?
1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one has a molecular weight of 275.31 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-phenyl-5H-imidazo[1,5-a]quinoxalin-4-one is sourced from PubChem (CID 11369390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).