1-(3-fluorophenyl)indazol-6-ol

C13H9FN2O — CID 136699638

IUPAC1-(3-fluorophenyl)indazol-6-ol
SMILESOc1ccc2cnn(-c3cccc(F)c3)c2c1
InChIInChI=1S/C13H9FN2O/c14-10-2-1-3-11(6-10)16-13-7-12(17)5-4-9(13)8-15-16/h1-8,17H
InChIKeyMTTKCSAJFYTFJK-UHFFFAOYSA-N
MW228.23 g/mol
LogP2.87
Rot. Bonds1

About 1-(3-fluorophenyl)indazol-6-ol

1-(3-fluorophenyl)indazol-6-ol (PubChem CID 136699638) has the molecular formula C13H9FN2O and a molecular weight of 228.23 g/mol. Its IUPAC name is 1-(3-fluorophenyl)indazol-6-ol.

Molecular Properties

Compound Name1-(3-fluorophenyl)indazol-6-ol
PubChem CID136699638
Molecular FormulaC13H9FN2O
Molecular Weight228.23 g/mol
Exact Mass228.07
IUPAC Name1-(3-fluorophenyl)indazol-6-ol
SMILESOc1ccc2cnn(-c3cccc(F)c3)c2c1
InChIInChI=1S/C13H9FN2O/c14-10-2-1-3-11(6-10)16-13-7-12(17)5-4-9(13)8-15-16/h1-8,17H
InChIKeyMTTKCSAJFYTFJK-UHFFFAOYSA-N
XLogP2.87
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.23
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)indazol-6-ol?
The IUPAC name of 1-(3-fluorophenyl)indazol-6-ol (CID 136699638) is 1-(3-fluorophenyl)indazol-6-ol.
What is the SMILES notation for 1-(3-fluorophenyl)indazol-6-ol?
The canonical SMILES for 1-(3-fluorophenyl)indazol-6-ol is Oc1ccc2cnn(-c3cccc(F)c3)c2c1.
What is the InChIKey of 1-(3-fluorophenyl)indazol-6-ol?
The InChIKey is MTTKCSAJFYTFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2O/c14-10-2-1-3-11(6-10)16-13-7-12(17)5-4-9(13)8-15-16/h1-8,17H.
What are the key properties of 1-(3-fluorophenyl)indazol-6-ol?
1-(3-fluorophenyl)indazol-6-ol has a molecular weight of 228.23 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)indazol-6-ol is sourced from PubChem (CID 136699638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).