2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine

C14H13F3N2O — CID 176690920

IUPAC2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine
SMILESCCc1cc(C)cc(Oc2cnc(C(F)(F)F)cn2)c1
InChIInChI=1S/C14H13F3N2O/c1-3-10-4-9(2)5-11(6-10)20-13-8-18-12(7-19-13)14(15,16)17/h4-8H,3H2,1-2H3
InChIKeyNFIWYHFKHUOJQW-UHFFFAOYSA-N
MW282.27 g/mol
LogP4.16
Rot. Bonds3

About 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine

2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine (PubChem CID 176690920) has the molecular formula C14H13F3N2O and a molecular weight of 282.27 g/mol. Its IUPAC name is 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine.

Molecular Properties

Compound Name2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine
PubChem CID176690920
Molecular FormulaC14H13F3N2O
Molecular Weight282.27 g/mol
Exact Mass282.10
IUPAC Name2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine
SMILESCCc1cc(C)cc(Oc2cnc(C(F)(F)F)cn2)c1
InChIInChI=1S/C14H13F3N2O/c1-3-10-4-9(2)5-11(6-10)20-13-8-18-12(7-19-13)14(15,16)17/h4-8H,3H2,1-2H3
InChIKeyNFIWYHFKHUOJQW-UHFFFAOYSA-N
XLogP4.16
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-Methyl-2-(1-methylethyl)phenoxy]pyrazine
CID 3708430
5-Isobutyl-3-methyl-2-phenoxypyrazine
CID 528137
3-[3-(Trifluoromethyl)phenoxy]pyrazine-2-carbonitrile
CID 2821109
N'-hydroxy-3-[3-(trifluoromethyl)phenoxy]pyrazine-2-carboximidamide
CID 2822034
{4-[(6-Methylpyrazin-2-yl)oxy]phenyl}methanol
CID 24229691
4-[(6-Methylpyrazin-2-yl)oxy]benzylamine
CID 24229693
3-Methyl-5-(3-methylpentyl)-2-phenoxypyrazine
CID 44327248
2-Phenoxy-5-propan-2-ylpyrazine
CID 44328027
2,5-Dimethyl-3-[3-methyl-5-(pyrrolidin-1-ylmethyl)phenoxy]pyrazine
CID 56707534
N'-hydroxy-3-[3-(trifluoromethyl)phenoxy]pyrazine-2-carboximidamide
CID 135983232
2-(4-(Isothiocyanatomethyl)phenoxy)-6-methylpyrazine
CID 118524782
5-(4-Chloro-3-ethylphenoxy)pyrazine-2-carbonitrile
CID 64272147

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine?
The IUPAC name of 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine (CID 176690920) is 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine.
What is the SMILES notation for 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine?
The canonical SMILES for 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine is CCc1cc(C)cc(Oc2cnc(C(F)(F)F)cn2)c1.
What is the InChIKey of 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine?
The InChIKey is NFIWYHFKHUOJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2O/c1-3-10-4-9(2)5-11(6-10)20-13-8-18-12(7-19-13)14(15,16)17/h4-8H,3H2,1-2H3.
What are the key properties of 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine?
2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine has a molecular weight of 282.27 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-5-methylphenoxy)-5-(trifluoromethyl)pyrazine is sourced from PubChem (CID 176690920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).