6-fluoro-3-phenyl-1H-indazole

C13H9FN2 — CID 164611597

IUPAC6-fluoro-3-phenyl-1H-indazole
SMILESFc1ccc2c(-c3ccccc3)n[nH]c2c1
InChIInChI=1S/C13H9FN2/c14-10-6-7-11-12(8-10)15-16-13(11)9-4-2-1-3-5-9/h1-8H,(H,15,16)
InChIKeyVEUGAPJJAWVQQB-UHFFFAOYSA-N
MW212.23 g/mol
LogP3.37
Rot. Bonds1

About 6-fluoro-3-phenyl-1H-indazole

6-fluoro-3-phenyl-1H-indazole (PubChem CID 164611597) has the molecular formula C13H9FN2 and a molecular weight of 212.23 g/mol. Its IUPAC name is 6-fluoro-3-phenyl-1H-indazole.

Molecular Properties

Compound Name6-fluoro-3-phenyl-1H-indazole
PubChem CID164611597
Molecular FormulaC13H9FN2
Molecular Weight212.23 g/mol
Exact Mass212.07
IUPAC Name6-fluoro-3-phenyl-1H-indazole
SMILESFc1ccc2c(-c3ccccc3)n[nH]c2c1
InChIInChI=1S/C13H9FN2/c14-10-6-7-11-12(8-10)15-16-13(11)9-4-2-1-3-5-9/h1-8H,(H,15,16)
InChIKeyVEUGAPJJAWVQQB-UHFFFAOYSA-N
XLogP3.37
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.23
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-phenyl-1H-indazole?
The IUPAC name of 6-fluoro-3-phenyl-1H-indazole (CID 164611597) is 6-fluoro-3-phenyl-1H-indazole.
What is the SMILES notation for 6-fluoro-3-phenyl-1H-indazole?
The canonical SMILES for 6-fluoro-3-phenyl-1H-indazole is Fc1ccc2c(-c3ccccc3)n[nH]c2c1.
What is the InChIKey of 6-fluoro-3-phenyl-1H-indazole?
The InChIKey is VEUGAPJJAWVQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2/c14-10-6-7-11-12(8-10)15-16-13(11)9-4-2-1-3-5-9/h1-8H,(H,15,16).
What are the key properties of 6-fluoro-3-phenyl-1H-indazole?
6-fluoro-3-phenyl-1H-indazole has a molecular weight of 212.23 g/mol, XLogP of 3.37, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-phenyl-1H-indazole is sourced from PubChem (CID 164611597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).