6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole

C10H9F3N6 — CID 22090568

IUPAC6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole
SMILESCc1cc(C)n(-c2cn3c(C(F)(F)F)n[nH]c3n2)n1
InChIInChI=1S/C10H9F3N6/c1-5-3-6(2)19(17-5)7-4-18-8(10(11,12)13)15-16-9(18)14-7/h3-4H,1-2H3,(H,14,16)
InChIKeyUFPZQHUWEHXTCG-UHFFFAOYSA-N
MW270.22 g/mol
LogP1.88
Rot. Bonds1

About 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole

6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole (PubChem CID 22090568) has the molecular formula C10H9F3N6 and a molecular weight of 270.22 g/mol. Its IUPAC name is 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole.

Molecular Properties

Compound Name6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole
PubChem CID22090568
Molecular FormulaC10H9F3N6
Molecular Weight270.22 g/mol
Exact Mass270.08
IUPAC Name6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole
SMILESCc1cc(C)n(-c2cn3c(C(F)(F)F)n[nH]c3n2)n1
InChIInChI=1S/C10H9F3N6/c1-5-3-6(2)19(17-5)7-4-18-8(10(11,12)13)15-16-9(18)14-7/h3-4H,1-2H3,(H,14,16)
InChIKeyUFPZQHUWEHXTCG-UHFFFAOYSA-N
XLogP1.88
TPSA63.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.22
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3,5-Dimethylpyrazol-1-yl)-3-(trifluoromethyl)imidazo[2,1-c][1,2,4]triazol-7-ide
CID 22090567
5-Methyl-1-(3-methylimidazol-4-yl)-3-(trifluoromethyl)pyrazole
CID 138654907
5-Methyl-1-(1-methylimidazol-4-yl)-3-(trifluoromethyl)pyrazole
CID 138654988
3,5-Dimethyl-1-[[1-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrrolidin-2-yl]methyl]pyrazole
CID 53627409
1-[[1-(Difluoromethyl)imidazol-2-yl]methyl]-3,5-dimethylpyrazole
CID 63810301
4-(1-methyl-1H-imidazol-2-yl)-1-{2-methyl-3-[3-methyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}-1H-1,2,3-triazole
CID 72864490
3,5-dimethyl-1-[[(2S)-1-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrrolidin-2-yl]methyl]pyrazole
CID 95354838
3,5-dimethyl-1-[[(2R)-1-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrrolidin-2-yl]methyl]pyrazole
CID 95354839
4-(1-methylimidazol-2-yl)-1-[(2R)-2-methyl-3-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]propyl]triazole
CID 97120750
4-(1-methylimidazol-2-yl)-1-[(2S)-2-methyl-3-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]propyl]triazole
CID 97120751
2-(6-(trifluoromethyl)-1H-imidazo[1,2-b]pyrazol-1-yl)acetimidamide
CID 121215003
6-[5-(difluoromethyl)-3-methylpyrazol-1-yl]-N-(1H-imidazol-2-ylmethyl)-N-methylpyrimidin-4-amine
CID 126836765

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole?
The IUPAC name of 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole (CID 22090568) is 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole.
What is the SMILES notation for 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole?
The canonical SMILES for 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole is Cc1cc(C)n(-c2cn3c(C(F)(F)F)n[nH]c3n2)n1.
What is the InChIKey of 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole?
The InChIKey is UFPZQHUWEHXTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N6/c1-5-3-6(2)19(17-5)7-4-18-8(10(11,12)13)15-16-9(18)14-7/h3-4H,1-2H3,(H,14,16).
What are the key properties of 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole?
6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole has a molecular weight of 270.22 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethylpyrazol-1-yl)-3-(trifluoromethyl)-1H-imidazo[2,1-c][1,2,4]triazole is sourced from PubChem (CID 22090568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).