2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine

C9H11F3N2O — CID 170748488

IUPAC2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine
SMILESCCOC(C)c1cncc(C(F)(F)F)n1
InChIInChI=1S/C9H11F3N2O/c1-3-15-6(2)7-4-13-5-8(14-7)9(10,11)12/h4-6H,3H2,1-2H3
InChIKeyVXWFGPRAYGTDBE-UHFFFAOYSA-N
MW220.19 g/mol
LogP2.59
Rot. Bonds3

About 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine

2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine (PubChem CID 170748488) has the molecular formula C9H11F3N2O and a molecular weight of 220.19 g/mol. Its IUPAC name is 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine.

Molecular Properties

Compound Name2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine
PubChem CID170748488
Molecular FormulaC9H11F3N2O
Molecular Weight220.19 g/mol
Exact Mass220.08
IUPAC Name2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine
SMILESCCOC(C)c1cncc(C(F)(F)F)n1
InChIInChI=1S/C9H11F3N2O/c1-3-15-6(2)7-4-13-5-8(14-7)9(10,11)12/h4-6H,3H2,1-2H3
InChIKeyVXWFGPRAYGTDBE-UHFFFAOYSA-N
XLogP2.59
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.19
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(1-ethoxyethyl)-6-(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-Methoxy-(3,5 or 6)-methylpyrazine
CID 113204
Pyrazine, 2-ethoxymethyl-
CID 103404
2,5-Bis(methoxymethyl)pyrazine
CID 14257640
1-Methoxy-isobutyl pyrazine
CID 54145268
2-(1,4-Dioxan-2-yl)pyrazine
CID 67225701
2-(1-Ethoxyethyl)pyrazine
CID 71406239
2-(1-Ethoxyethenyl)-6-(trifluoromethyl)pyrazine
CID 164920686
1-(6-(Trifluoromethyl)pyrazin-2-yl)ethan-1-ol
CID 164920760
2-(1-Ethoxyethenyl)-5-(trifluoromethyl)pyrazine
CID 166150427
1-[5-(Trifluoromethyl)pyrazin-2-yl]ethanol
CID 167221132
2-(1-Methylsulfanyloxyethyl)-6-(trifluoromethyl)pyrazine
CID 169267616
2-Fluoro-5-(propan-2-yloxymethyl)pyrazine
CID 170969516

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine?
The IUPAC name of 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine (CID 170748488) is 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine.
What is the SMILES notation for 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine?
The canonical SMILES for 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine is CCOC(C)c1cncc(C(F)(F)F)n1.
What is the InChIKey of 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine?
The InChIKey is VXWFGPRAYGTDBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N2O/c1-3-15-6(2)7-4-13-5-8(14-7)9(10,11)12/h4-6H,3H2,1-2H3.
What are the key properties of 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine?
2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine has a molecular weight of 220.19 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxyethyl)-6-(trifluoromethyl)pyrazine is sourced from PubChem (CID 170748488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).