2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline

C12H10ClF3N2O — CID 123460258

IUPAC2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline
SMILESCCc1cc2nc(Cl)c(C(F)(F)F)nc2cc1OC
InChIInChI=1S/C12H10ClF3N2O/c1-3-6-4-7-8(5-9(6)19-2)17-10(11(13)18-7)12(14,15)16/h4-5H,3H2,1-2H3
InChIKeyYDXWIUDJZKVQMU-UHFFFAOYSA-N
MW290.67 g/mol
LogP3.87
Rot. Bonds2

About 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline

2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline (PubChem CID 123460258) has the molecular formula C12H10ClF3N2O and a molecular weight of 290.67 g/mol. Its IUPAC name is 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline.

Molecular Properties

Compound Name2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline
PubChem CID123460258
Molecular FormulaC12H10ClF3N2O
Molecular Weight290.67 g/mol
Exact Mass290.04
IUPAC Name2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline
SMILESCCc1cc2nc(Cl)c(C(F)(F)F)nc2cc1OC
InChIInChI=1S/C12H10ClF3N2O/c1-3-6-4-7-8(5-9(6)19-2)17-10(11(13)18-7)12(14,15)16/h4-5H,3H2,1-2H3
InChIKeyYDXWIUDJZKVQMU-UHFFFAOYSA-N
XLogP3.87
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.67
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-chloro-4-ethyl-2,5-dimethoxybenzene
CID 71132798
(2-chloro-6,7-dimethoxyquinolin-3-yl)methanol
CID 13482290
ethyl 2-chloro-3-(trifluoromethyl)thieno[2,3-b]pyrazine-6-carboxylate
CID 177236659
2-chloro-4-ethyl-7-fluoro-6-methoxyquinoline
CID 87401887
4-chloro-6,7-dimethoxy-2-(trifluoromethyl)quinazoline
CID 22693550
2-chloro-3-methoxy-6-(trifluoromethyl)quinoline
CID 117246626
2,6-dichloro-3-ethyl-5-(trifluoromethyl)pyridine
CID 139336058
[6-(2,6-diethylphenyl)-4-methoxy-2-(trifluoromethyl)-3-pyridinyl]methanol
CID 59678353
(3-chloro-6,7-dimethoxyquinoxalin-2-yl)hydrazine
CID 142406445
2-[6-(difluoromethyl)-5-methoxy-2-(trifluoromethyl)-3-pyridinyl]acetic acid
CID 118820536
2-chloro-6-ethoxy-7-methoxyquinazoline
CID 141299474
2-(fluoromethyl)-3-methoxy-5-(trifluoromethoxy)-6-(trifluoromethyl)pyridine
CID 134669983

Frequently Asked Questions

What is the IUPAC name of 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline?
The IUPAC name of 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline (CID 123460258) is 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline.
What is the SMILES notation for 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline?
The canonical SMILES for 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline is CCc1cc2nc(Cl)c(C(F)(F)F)nc2cc1OC.
What is the InChIKey of 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline?
The InChIKey is YDXWIUDJZKVQMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClF3N2O/c1-3-6-4-7-8(5-9(6)19-2)17-10(11(13)18-7)12(14,15)16/h4-5H,3H2,1-2H3.
What are the key properties of 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline?
2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline has a molecular weight of 290.67 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-7-ethyl-6-methoxy-3-(trifluoromethyl)quinoxaline is sourced from PubChem (CID 123460258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).