2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine

C16H12F3N5 — CID 134452874

IUPAC2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1nc2c(-c3cc(C)c4[nH]ncc4c3)c(C(F)(F)F)ccn2n1
InChIInChI=1S/C16H12F3N5/c1-8-5-10(6-11-7-20-22-14(8)11)13-12(16(17,18)19)3-4-24-15(13)21-9(2)23-24/h3-7H,1-2H3,(H,20,22)
InChIKeyFELYLJINEBSAMA-UHFFFAOYSA-N
MW331.30 g/mol
LogP3.91
Rot. Bonds1

About 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine

2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 134452874) has the molecular formula C16H12F3N5 and a molecular weight of 331.30 g/mol. Its IUPAC name is 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID134452874
Molecular FormulaC16H12F3N5
Molecular Weight331.30 g/mol
Exact Mass331.10
IUPAC Name2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1nc2c(-c3cc(C)c4[nH]ncc4c3)c(C(F)(F)F)ccn2n1
InChIInChI=1S/C16H12F3N5/c1-8-5-10(6-11-7-20-22-14(8)11)13-12(16(17,18)19)3-4-24-15(13)21-9(2)23-24/h3-7H,1-2H3,(H,20,22)
InChIKeyFELYLJINEBSAMA-UHFFFAOYSA-N
XLogP3.91
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.30
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine with MolForge

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Related Compounds

7-isocyano-8-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 140866015
2-(difluoromethyl)-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 134452890
8-(7-chloro-1H-indazol-5-yl)-2,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine
CID 134450127
7-(azetidin-1-yl)-8-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 134450106
8-(7-chloro-1H-indazol-5-yl)-2-cyclopropyl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 134452937
7-methyl-8-(7-methyl-1H-indazol-5-yl)-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 134450132
7-(cyclopenten-1-yl)-8-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 140866012
7-(7-methyl-1H-indazol-5-yl)-2-propan-2-yl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 134457801
2-(difluoromethyl)-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)imidazo[1,2-c]pyrimidine
CID 134474752
5-(7-chloro-1H-indazol-5-yl)-2-methyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 134457793
5-(7-chloro-1H-indazol-5-yl)-8-methyl-2-propyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 134457816
7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine
CID 122654595

Frequently Asked Questions

What is the IUPAC name of 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine (CID 134452874) is 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine is Cc1nc2c(-c3cc(C)c4[nH]ncc4c3)c(C(F)(F)F)ccn2n1.
What is the InChIKey of 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is FELYLJINEBSAMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F3N5/c1-8-5-10(6-11-7-20-22-14(8)11)13-12(16(17,18)19)3-4-24-15(13)21-9(2)23-24/h3-7H,1-2H3,(H,20,22).
What are the key properties of 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine?
2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 331.30 g/mol, XLogP of 3.91, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-8-(7-methyl-1H-indazol-5-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 134452874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).