2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine

C8H6F3N3 — CID 118987114

IUPAC2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine
SMILESCn1cc2ncc(C(F)(F)F)cc2n1
InChIInChI=1S/C8H6F3N3/c1-14-4-7-6(13-14)2-5(3-12-7)8(9,10)11/h2-4H,1H3
InChIKeyXSUQBXUVJIQMEF-UHFFFAOYSA-N
MW201.15 g/mol
LogP1.99
Rot. Bonds

About 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine

2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine (PubChem CID 118987114) has the molecular formula C8H6F3N3 and a molecular weight of 201.15 g/mol. Its IUPAC name is 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine
PubChem CID118987114
Molecular FormulaC8H6F3N3
Molecular Weight201.15 g/mol
Exact Mass201.05
IUPAC Name2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine
SMILESCn1cc2ncc(C(F)(F)F)cc2n1
InChIInChI=1S/C8H6F3N3/c1-14-4-7-6(13-14)2-5(3-12-7)8(9,10)11/h2-4H,1H3
InChIKeyXSUQBXUVJIQMEF-UHFFFAOYSA-N
XLogP1.99
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.15
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine?
The IUPAC name of 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine (CID 118987114) is 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine.
What is the SMILES notation for 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine?
The canonical SMILES for 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine is Cn1cc2ncc(C(F)(F)F)cc2n1.
What is the InChIKey of 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine?
The InChIKey is XSUQBXUVJIQMEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F3N3/c1-14-4-7-6(13-14)2-5(3-12-7)8(9,10)11/h2-4H,1H3.
What are the key properties of 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine?
2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine has a molecular weight of 201.15 g/mol, XLogP of 1.99, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(trifluoromethyl)pyrazolo[4,3-b]pyridine is sourced from PubChem (CID 118987114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).