5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine

C16H10F5N5 — CID 175695555

IUPAC5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine
SMILESFC(F)(F)C(F)(F)Cn1ncc2cc(-n3cc4ccccc4n3)ncc21
InChIInChI=1S/C16H10F5N5/c17-15(18,16(19,20)21)9-26-13-7-22-14(5-11(13)6-23-26)25-8-10-3-1-2-4-12(10)24-25/h1-8H,9H2
InChIKeyUQXZBDYBDTWRNQ-UHFFFAOYSA-N
MW367.28 g/mol
LogP3.97
Rot. Bonds3

About 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine

5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine (PubChem CID 175695555) has the molecular formula C16H10F5N5 and a molecular weight of 367.28 g/mol. Its IUPAC name is 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine
PubChem CID175695555
Molecular FormulaC16H10F5N5
Molecular Weight367.28 g/mol
Exact Mass367.09
IUPAC Name5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine
SMILESFC(F)(F)C(F)(F)Cn1ncc2cc(-n3cc4ccccc4n3)ncc21
InChIInChI=1S/C16H10F5N5/c17-15(18,16(19,20)21)9-26-13-7-22-14(5-11(13)6-23-26)25-8-10-3-1-2-4-12(10)24-25/h1-8H,9H2
InChIKeyUQXZBDYBDTWRNQ-UHFFFAOYSA-N
XLogP3.97
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.28
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine?
The IUPAC name of 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine (CID 175695555) is 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine?
The canonical SMILES for 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine is FC(F)(F)C(F)(F)Cn1ncc2cc(-n3cc4ccccc4n3)ncc21.
What is the InChIKey of 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine?
The InChIKey is UQXZBDYBDTWRNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F5N5/c17-15(18,16(19,20)21)9-26-13-7-22-14(5-11(13)6-23-26)25-8-10-3-1-2-4-12(10)24-25/h1-8H,9H2.
What are the key properties of 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine?
5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine has a molecular weight of 367.28 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-indazol-2-yl-1-(2,2,3,3,3-pentafluoropropyl)pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 175695555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).