4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine

C6H9F3N2 — CID 68888872

IUPAC4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine
SMILESCN1C=C(C(F)(F)F)NCC1
InChIInChI=1S/C6H9F3N2/c1-11-3-2-10-5(4-11)6(7,8)9/h4,10H,2-3H2,1H3
InChIKeyMTFCXQSUWMCBBZ-UHFFFAOYSA-N
MW166.15 g/mol
LogP0.93
Rot. Bonds

About 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine

4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine (PubChem CID 68888872) has the molecular formula C6H9F3N2 and a molecular weight of 166.15 g/mol. Its IUPAC name is 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine.

Molecular Properties

Compound Name4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine
PubChem CID68888872
Molecular FormulaC6H9F3N2
Molecular Weight166.15 g/mol
Exact Mass166.07
IUPAC Name4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine
SMILESCN1C=C(C(F)(F)F)NCC1
InChIInChI=1S/C6H9F3N2/c1-11-3-2-10-5(4-11)6(7,8)9/h4,10H,2-3H2,1H3
InChIKeyMTFCXQSUWMCBBZ-UHFFFAOYSA-N
XLogP0.93
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.15
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine?
The IUPAC name of 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine (CID 68888872) is 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine.
What is the SMILES notation for 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine?
The canonical SMILES for 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine is CN1C=C(C(F)(F)F)NCC1.
What is the InChIKey of 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine?
The InChIKey is MTFCXQSUWMCBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F3N2/c1-11-3-2-10-5(4-11)6(7,8)9/h4,10H,2-3H2,1H3.
What are the key properties of 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine?
4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine has a molecular weight of 166.15 g/mol, XLogP of 0.93, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyrazine is sourced from PubChem (CID 68888872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).