8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one

C11H5ClF3N3O — CID 140991165

IUPAC8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one
SMILESO=c1[nH]c2cc(C(F)(F)F)c(Cl)cc2n2ccnc12
InChIInChI=1S/C11H5ClF3N3O/c12-6-4-8-7(3-5(6)11(13,14)15)17-10(19)9-16-1-2-18(8)9/h1-4H,(H,17,19)
InChIKeyWYKJSEOWCLRFOO-UHFFFAOYSA-N
MW287.63 g/mol
LogP2.85
Rot. Bonds

About 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one

8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one (PubChem CID 140991165) has the molecular formula C11H5ClF3N3O and a molecular weight of 287.63 g/mol. Its IUPAC name is 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one.

Molecular Properties

Compound Name8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one
PubChem CID140991165
Molecular FormulaC11H5ClF3N3O
Molecular Weight287.63 g/mol
Exact Mass287.01
IUPAC Name8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one
SMILESO=c1[nH]c2cc(C(F)(F)F)c(Cl)cc2n2ccnc12
InChIInChI=1S/C11H5ClF3N3O/c12-6-4-8-7(3-5(6)11(13,14)15)17-10(19)9-16-1-2-18(8)9/h1-4H,(H,17,19)
InChIKeyWYKJSEOWCLRFOO-UHFFFAOYSA-N
XLogP2.85
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.63
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]quinoxalin-4(5H)-one
CID 25156561
7-((dimethylamino)methyl)imidazo[1,2-a]quinoxalin-4(5H)-one
CID 45271137
6,7-Dichloro-5-[(2-methylimidazol-1-yl)methyl]-1,4-dihydroquinoxaline-2,3-dione
CID 10606636
6,7-Dichloro-5-(imidazol-1-ylmethyl)-1,4-dihydroquinoxaline-2,3-dione
CID 10733778
7,8-dichloroimidazo[1,2-a]quinoxalin-4(5H)-one
CID 10037930
N-(3-chloro-4-(trifluoromethyl)phenyl)-1-(2-(pyridin-4-yl)ethyl)-1H-imidazole-2-carboxamide
CID 44431927
N-(3-chloro-4-(trifluoromethyl)phenyl)-1-(2-(pyridin-4-yl)ethyl)-1H-benzo[d]imidazole-2-carboxamide
CID 44431932
N-(3-chloro-4-methylphenyl)-2-[4-(1-methylimidazol-2-yl)piperazin-1-yl]acetamide
CID 25849828
1-(4-Chlorophenyl)-3-[2-(2-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]urea
CID 5148227
1-(4-Chlorophenyl)-3-[2-imidazol-1-yl-5-(trifluoromethyl)phenyl]urea
CID 4163767
1-(3-Chlorophenyl)-3-[2-imidazol-1-yl-5-(trifluoromethyl)phenyl]urea
CID 4323525
1-[4-Chloro-3-(trifluoromethyl)phenyl]-3-(2-imidazol-1-ylphenyl)urea
CID 12911667

Frequently Asked Questions

What is the IUPAC name of 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one?
The IUPAC name of 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one (CID 140991165) is 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one.
What is the SMILES notation for 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one?
The canonical SMILES for 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one is O=c1[nH]c2cc(C(F)(F)F)c(Cl)cc2n2ccnc12.
What is the InChIKey of 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one?
The InChIKey is WYKJSEOWCLRFOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5ClF3N3O/c12-6-4-8-7(3-5(6)11(13,14)15)17-10(19)9-16-1-2-18(8)9/h1-4H,(H,17,19).
What are the key properties of 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one?
8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one has a molecular weight of 287.63 g/mol, XLogP of 2.85, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-7-(trifluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one is sourced from PubChem (CID 140991165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).