6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile

C8H3BrFN3O — CID 175864833

IUPAC6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESN#Cc1c(F)nn2cc(Br)cc(O)c12
InChIInChI=1S/C8H3BrFN3O/c9-4-1-6(14)7-5(2-11)8(10)12-13(7)3-4/h1,3,14H
InChIKeyYCDSDDCDBHEXGS-UHFFFAOYSA-N
MW256.03 g/mol
LogP1.81
Rot. Bonds

About 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile

6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 175864833) has the molecular formula C8H3BrFN3O and a molecular weight of 256.03 g/mol. Its IUPAC name is 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID175864833
Molecular FormulaC8H3BrFN3O
Molecular Weight256.03 g/mol
Exact Mass254.94
IUPAC Name6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESN#Cc1c(F)nn2cc(Br)cc(O)c12
InChIInChI=1S/C8H3BrFN3O/c9-4-1-6(14)7-5(2-11)8(10)12-13(7)3-4/h1,3,14H
InChIKeyYCDSDDCDBHEXGS-UHFFFAOYSA-N
XLogP1.81
TPSA61.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.03
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile (CID 175864833) is 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile is N#Cc1c(F)nn2cc(Br)cc(O)c12.
What is the InChIKey of 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is YCDSDDCDBHEXGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3BrFN3O/c9-4-1-6(14)7-5(2-11)8(10)12-13(7)3-4/h1,3,14H.
What are the key properties of 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile?
6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 256.03 g/mol, XLogP of 1.81, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-fluoro-4-hydroxypyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 175864833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).