5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine

C11H7F6N3 — CID 157464435

IUPAC5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine
SMILESCc1cc(C(F)(F)F)nn1-c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C11H7F6N3/c1-6-4-9(11(15,16)17)19-20(6)7-2-3-8(18-5-7)10(12,13)14/h2-5H,1H3
InChIKeyORFLGGGXDPADQF-UHFFFAOYSA-N
MW295.19 g/mol
LogP3.61
Rot. Bonds1

About 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine

5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine (PubChem CID 157464435) has the molecular formula C11H7F6N3 and a molecular weight of 295.19 g/mol. Its IUPAC name is 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine
PubChem CID157464435
Molecular FormulaC11H7F6N3
Molecular Weight295.19 g/mol
Exact Mass295.05
IUPAC Name5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine
SMILESCc1cc(C(F)(F)F)nn1-c1ccc(C(F)(F)F)nc1
InChIInChI=1S/C11H7F6N3/c1-6-4-9(11(15,16)17)19-20(6)7-2-3-8(18-5-7)10(12,13)14/h2-5H,1H3
InChIKeyORFLGGGXDPADQF-UHFFFAOYSA-N
XLogP3.61
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.19
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine 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 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine?
The IUPAC name of 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine (CID 157464435) is 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine?
The canonical SMILES for 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine is Cc1cc(C(F)(F)F)nn1-c1ccc(C(F)(F)F)nc1.
What is the InChIKey of 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine?
The InChIKey is ORFLGGGXDPADQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F6N3/c1-6-4-9(11(15,16)17)19-20(6)7-2-3-8(18-5-7)10(12,13)14/h2-5H,1H3.
What are the key properties of 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine?
5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine has a molecular weight of 295.19 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 157464435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).