4-fluoro-6-methoxy-1H-indazole

C8H7FN2O — CID 24728522

IUPAC4-fluoro-6-methoxy-1H-indazole
SMILESCOc1cc(F)c2cn[nH]c2c1
InChIInChI=1S/C8H7FN2O/c1-12-5-2-7(9)6-4-10-11-8(6)3-5/h2-4H,1H3,(H,10,11)
InChIKeyLBQJKJFSQIFIQF-UHFFFAOYSA-N
MW166.16 g/mol
LogP1.71
Rot. Bonds1

About 4-fluoro-6-methoxy-1H-indazole

4-fluoro-6-methoxy-1H-indazole (PubChem CID 24728522) has the molecular formula C8H7FN2O and a molecular weight of 166.16 g/mol. Its IUPAC name is 4-fluoro-6-methoxy-1H-indazole.

Molecular Properties

Compound Name4-fluoro-6-methoxy-1H-indazole
PubChem CID24728522
Molecular FormulaC8H7FN2O
Molecular Weight166.16 g/mol
Exact Mass166.05
IUPAC Name4-fluoro-6-methoxy-1H-indazole
SMILESCOc1cc(F)c2cn[nH]c2c1
InChIInChI=1S/C8H7FN2O/c1-12-5-2-7(9)6-4-10-11-8(6)3-5/h2-4H,1H3,(H,10,11)
InChIKeyLBQJKJFSQIFIQF-UHFFFAOYSA-N
XLogP1.71
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.16
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-methoxy-1H-indazole?
The IUPAC name of 4-fluoro-6-methoxy-1H-indazole (CID 24728522) is 4-fluoro-6-methoxy-1H-indazole.
What is the SMILES notation for 4-fluoro-6-methoxy-1H-indazole?
The canonical SMILES for 4-fluoro-6-methoxy-1H-indazole is COc1cc(F)c2cn[nH]c2c1.
What is the InChIKey of 4-fluoro-6-methoxy-1H-indazole?
The InChIKey is LBQJKJFSQIFIQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN2O/c1-12-5-2-7(9)6-4-10-11-8(6)3-5/h2-4H,1H3,(H,10,11).
What are the key properties of 4-fluoro-6-methoxy-1H-indazole?
4-fluoro-6-methoxy-1H-indazole has a molecular weight of 166.16 g/mol, XLogP of 1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-methoxy-1H-indazole is sourced from PubChem (CID 24728522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).