6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline

C22H13F3N2 — CID 56925609

IUPAC6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline
SMILESFC(F)(F)c1ccc(-c2nc3ccccc3n3c2cc2ccccc23)cc1
InChIInChI=1S/C22H13F3N2/c23-22(24,25)16-11-9-14(10-12-16)21-20-13-15-5-1-3-7-18(15)27(20)19-8-4-2-6-17(19)26-21/h1-13H
InChIKeyWBZQSBPNSZHCGC-UHFFFAOYSA-N
MW362.35 g/mol
LogP6.33
Rot. Bonds1

About 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline

6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline (PubChem CID 56925609) has the molecular formula C22H13F3N2 and a molecular weight of 362.35 g/mol. Its IUPAC name is 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline
PubChem CID56925609
Molecular FormulaC22H13F3N2
Molecular Weight362.35 g/mol
Exact Mass362.10
IUPAC Name6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline
SMILESFC(F)(F)c1ccc(-c2nc3ccccc3n3c2cc2ccccc23)cc1
InChIInChI=1S/C22H13F3N2/c23-22(24,25)16-11-9-14(10-12-16)21-20-13-15-5-1-3-7-18(15)27(20)19-8-4-2-6-17(19)26-21/h1-13H
InChIKeyWBZQSBPNSZHCGC-UHFFFAOYSA-N
XLogP6.33
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.35
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Bathocuproine
CID 65149
Cryptolepine
CID 82143
Cryptolepine hydrochloride
CID 156093
2-(4-Methylphenyl)-3-phenylquinoxaline
CID 2295348
2,3-Diphenylquinoxaline
CID 74311
8-fluoro-5-(4-fluorophenyl)-2-(2-quinolin-2-ylethyl)-3,4-dihydro-1H-pyrido[4,3-b]indole;hydrochloride
CID 54586686
5,11-Dimethylindolo[3,2-b]quinoline
CID 10705591
2-Phenyl-3-(trifluoromethyl)quinoxaline
CID 2832386
4-(Difluoromethyl)-6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methylquinoline
CID 162649846
4-Benzylpyrrolo[1,2-a]quinoxaline
CID 164621618
5,10-Dimethylindolo[3,2-b]quinolin-5-ium;trifluoromethanesulfonate
CID 10786910
9-[3-(4-Phenylpiperazino)propyl]-9H-carbazole
CID 410922

Frequently Asked Questions

What is the IUPAC name of 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline?
The IUPAC name of 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline (CID 56925609) is 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline.
What is the SMILES notation for 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline?
The canonical SMILES for 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline is FC(F)(F)c1ccc(-c2nc3ccccc3n3c2cc2ccccc23)cc1.
What is the InChIKey of 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline?
The InChIKey is WBZQSBPNSZHCGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H13F3N2/c23-22(24,25)16-11-9-14(10-12-16)21-20-13-15-5-1-3-7-18(15)27(20)19-8-4-2-6-17(19)26-21/h1-13H.
What are the key properties of 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline?
6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline has a molecular weight of 362.35 g/mol, XLogP of 6.33, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(trifluoromethyl)phenyl]indolo[1,2-a]quinoxaline is sourced from PubChem (CID 56925609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).