7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine

C16H8ClF5N4 — CID 134452624

IUPAC7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESFC(F)c1ccc2cc(C(F)(F)F)nn2c1-c1cc(Cl)c2[nH]ncc2c1
InChIInChI=1S/C16H8ClF5N4/c17-11-4-7(3-8-6-23-24-13(8)11)14-10(15(18)19)2-1-9-5-12(16(20,21)22)25-26(9)14/h1-6,15H,(H,23,24)
InChIKeyYVOMWJJGTRYZSD-UHFFFAOYSA-N
MW386.71 g/mol
LogP5.49
Rot. Bonds2

About 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine

7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine (PubChem CID 134452624) has the molecular formula C16H8ClF5N4 and a molecular weight of 386.71 g/mol. Its IUPAC name is 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine
PubChem CID134452624
Molecular FormulaC16H8ClF5N4
Molecular Weight386.71 g/mol
Exact Mass386.04
IUPAC Name7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESFC(F)c1ccc2cc(C(F)(F)F)nn2c1-c1cc(Cl)c2[nH]ncc2c1
InChIInChI=1S/C16H8ClF5N4/c17-11-4-7(3-8-6-23-24-13(8)11)14-10(15(18)19)2-1-9-5-12(16(20,21)22)25-26(9)14/h1-6,15H,(H,23,24)
InChIKeyYVOMWJJGTRYZSD-UHFFFAOYSA-N
XLogP5.49
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.71
LogP ≤ 55.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine (CID 134452624) is 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine is FC(F)c1ccc2cc(C(F)(F)F)nn2c1-c1cc(Cl)c2[nH]ncc2c1.
What is the InChIKey of 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The InChIKey is YVOMWJJGTRYZSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H8ClF5N4/c17-11-4-7(3-8-6-23-24-13(8)11)14-10(15(18)19)2-1-9-5-12(16(20,21)22)25-26(9)14/h1-6,15H,(H,23,24).
What are the key properties of 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine has a molecular weight of 386.71 g/mol, XLogP of 5.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(7-chloro-1H-indazol-5-yl)-6-(difluoromethyl)-2-(trifluoromethyl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 134452624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).