6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine

C7H4F3N3O — CID 138110001

IUPAC6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine
SMILESFC(F)(F)Oc1cnc2cn[nH]c2c1
InChIInChI=1S/C7H4F3N3O/c8-7(9,10)14-4-1-5-6(11-2-4)3-12-13-5/h1-3H,(H,12,13)
InChIKeyHZJJLSILVDCVQK-UHFFFAOYSA-N
MW203.12 g/mol
LogP1.86
Rot. Bonds1

About 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine

6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine (PubChem CID 138110001) has the molecular formula C7H4F3N3O and a molecular weight of 203.12 g/mol. Its IUPAC name is 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine
PubChem CID138110001
Molecular FormulaC7H4F3N3O
Molecular Weight203.12 g/mol
Exact Mass203.03
IUPAC Name6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine
SMILESFC(F)(F)Oc1cnc2cn[nH]c2c1
InChIInChI=1S/C7H4F3N3O/c8-7(9,10)14-4-1-5-6(11-2-4)3-12-13-5/h1-3H,(H,12,13)
InChIKeyHZJJLSILVDCVQK-UHFFFAOYSA-N
XLogP1.86
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.12
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine?
The IUPAC name of 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine (CID 138110001) is 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine?
The canonical SMILES for 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine is FC(F)(F)Oc1cnc2cn[nH]c2c1.
What is the InChIKey of 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine?
The InChIKey is HZJJLSILVDCVQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F3N3O/c8-7(9,10)14-4-1-5-6(11-2-4)3-12-13-5/h1-3H,(H,12,13).
What are the key properties of 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine?
6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine has a molecular weight of 203.12 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethoxy)-1H-pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 138110001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).