2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline

C16H12F2N2O3 — CID 139233536

IUPAC2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline
SMILESCOc1c(F)cc(Oc2cnc3ccccc3n2)c(F)c1OC
InChIInChI=1S/C16H12F2N2O3/c1-21-15-9(17)7-12(14(18)16(15)22-2)23-13-8-19-10-5-3-4-6-11(10)20-13/h3-8H,1-2H3
InChIKeyOUDVLGHDLAXCMW-UHFFFAOYSA-N
MW318.28 g/mol
LogP3.72
Rot. Bonds4

About 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline

2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline (PubChem CID 139233536) has the molecular formula C16H12F2N2O3 and a molecular weight of 318.28 g/mol. Its IUPAC name is 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline.

Molecular Properties

Compound Name2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline
PubChem CID139233536
Molecular FormulaC16H12F2N2O3
Molecular Weight318.28 g/mol
Exact Mass318.08
IUPAC Name2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline
SMILESCOc1c(F)cc(Oc2cnc3ccccc3n2)c(F)c1OC
InChIInChI=1S/C16H12F2N2O3/c1-21-15-9(17)7-12(14(18)16(15)22-2)23-13-8-19-10-5-3-4-6-11(10)20-13/h3-8H,1-2H3
InChIKeyOUDVLGHDLAXCMW-UHFFFAOYSA-N
XLogP3.72
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.28
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-Phenoxyquinoxaline
CID 3734282
2-(4-Methoxyphenoxy)-3-(trifluoromethyl)quinoxaline
CID 1470962
2-(4-Methoxyphenoxy)quinoxaline
CID 3586870
2-(4-Fluorophenoxy)quinoxaline
CID 4363978
4-(4-Methoxyphenoxy)pyrrolo[1,2-a]quinoxaline
CID 3500346
2-[4-(6-Fluoroquinoxalin-2-yl)oxyphenoxy]propanoic acid
CID 12797670
2-[4-(7-Fluoroquinoxalin-2-yl)oxyphenoxy]propanoic acid
CID 24843442
Methyl 2-[4-(7-fluoroquinoxalin-2-yl)oxyphenoxy]propanoate
CID 44295008
4-[(3,4,5-Trimethoxyphenoxy)methyl]pyrrolo[1,2-a]quinoxaline
CID 399540
4-[(3,5-Dimethoxyphenoxy)methyl]pyrrolo[1,2-a]quinoxaline
CID 509474
7-(Trifluoromethyl)-4-[(3,4,5-trimethoxyphenoxy)methyl]pyrrolo[1,2-a]quinoxaline
CID 509477
2-(4-Fluorophenyl)-3-(3-methoxyphenoxy)pyrazine
CID 172433521

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline?
The IUPAC name of 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline (CID 139233536) is 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline.
What is the SMILES notation for 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline?
The canonical SMILES for 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline is COc1c(F)cc(Oc2cnc3ccccc3n2)c(F)c1OC.
What is the InChIKey of 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline?
The InChIKey is OUDVLGHDLAXCMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2N2O3/c1-21-15-9(17)7-12(14(18)16(15)22-2)23-13-8-19-10-5-3-4-6-11(10)20-13/h3-8H,1-2H3.
What are the key properties of 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline?
2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline has a molecular weight of 318.28 g/mol, XLogP of 3.72, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluoro-3,4-dimethoxyphenoxy)quinoxaline is sourced from PubChem (CID 139233536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).