2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine

C16H10F5N5 — CID 134450044

IUPAC2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine
SMILESCc1cc(-c2c3nc(C(F)(F)F)ccc3nn2C(F)F)cc2cn[nH]c12
InChIInChI=1S/C16H10F5N5/c1-7-4-8(5-9-6-22-24-12(7)9)14-13-10(25-26(14)15(17)18)2-3-11(23-13)16(19,20)21/h2-6,15H,1H3,(H,22,24)
InChIKeyCGSIRALUIGGXJZ-UHFFFAOYSA-N
MW367.28 g/mol
LogP4.70
Rot. Bonds2

About 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine

2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine (PubChem CID 134450044) has the molecular formula C16H10F5N5 and a molecular weight of 367.28 g/mol. Its IUPAC name is 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine
PubChem CID134450044
Molecular FormulaC16H10F5N5
Molecular Weight367.28 g/mol
Exact Mass367.09
IUPAC Name2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine
SMILESCc1cc(-c2c3nc(C(F)(F)F)ccc3nn2C(F)F)cc2cn[nH]c12
InChIInChI=1S/C16H10F5N5/c1-7-4-8(5-9-6-22-24-12(7)9)14-13-10(25-26(14)15(17)18)2-3-11(23-13)16(19,20)21/h2-6,15H,1H3,(H,22,24)
InChIKeyCGSIRALUIGGXJZ-UHFFFAOYSA-N
XLogP4.70
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.28
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine?
The IUPAC name of 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine (CID 134450044) is 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine.
What is the SMILES notation for 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine?
The canonical SMILES for 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine is Cc1cc(-c2c3nc(C(F)(F)F)ccc3nn2C(F)F)cc2cn[nH]c12.
What is the InChIKey of 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine?
The InChIKey is CGSIRALUIGGXJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F5N5/c1-7-4-8(5-9-6-22-24-12(7)9)14-13-10(25-26(14)15(17)18)2-3-11(23-13)16(19,20)21/h2-6,15H,1H3,(H,22,24).
What are the key properties of 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine?
2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine has a molecular weight of 367.28 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-5-(trifluoromethyl)pyrazolo[4,3-b]pyridine is sourced from PubChem (CID 134450044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).