7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine

C8H11F3N4 — CID 70966604

IUPAC7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCC1c2nc(C(F)(F)F)nn2CCN1C
InChIInChI=1S/C8H11F3N4/c1-5-6-12-7(8(9,10)11)13-15(6)4-3-14(5)2/h5H,3-4H2,1-2H3
InChIKeyRJKRJBHLYVOQPC-UHFFFAOYSA-N
MW220.20 g/mol
LogP1.30
Rot. Bonds

About 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine

7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 70966604) has the molecular formula C8H11F3N4 and a molecular weight of 220.20 g/mol. Its IUPAC name is 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID70966604
Molecular FormulaC8H11F3N4
Molecular Weight220.20 g/mol
Exact Mass220.09
IUPAC Name7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCC1c2nc(C(F)(F)F)nn2CCN1C
InChIInChI=1S/C8H11F3N4/c1-5-6-12-7(8(9,10)11)13-15(6)4-3-14(5)2/h5H,3-4H2,1-2H3
InChIKeyRJKRJBHLYVOQPC-UHFFFAOYSA-N
XLogP1.30
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine (CID 70966604) is 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine is CC1c2nc(C(F)(F)F)nn2CCN1C.
What is the InChIKey of 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is RJKRJBHLYVOQPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N4/c1-5-6-12-7(8(9,10)11)13-15(6)4-3-14(5)2/h5H,3-4H2,1-2H3.
What are the key properties of 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine?
7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 220.20 g/mol, XLogP of 1.30, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 70966604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).