3-(4-fluorophenyl)-1H-indazol-5-ol

C13H9FN2O — CID 71152082

IUPAC3-(4-fluorophenyl)-1H-indazol-5-ol
SMILESOc1ccc2[nH]nc(-c3ccc(F)cc3)c2c1
InChIInChI=1S/C13H9FN2O/c14-9-3-1-8(2-4-9)13-11-7-10(17)5-6-12(11)15-16-13/h1-7,17H,(H,15,16)
InChIKeyBFGGFCYAPPKBJD-UHFFFAOYSA-N
MW228.23 g/mol
LogP3.07
Rot. Bonds1

About 3-(4-fluorophenyl)-1H-indazol-5-ol

3-(4-fluorophenyl)-1H-indazol-5-ol (PubChem CID 71152082) has the molecular formula C13H9FN2O and a molecular weight of 228.23 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-1H-indazol-5-ol.

Molecular Properties

Compound Name3-(4-fluorophenyl)-1H-indazol-5-ol
PubChem CID71152082
Molecular FormulaC13H9FN2O
Molecular Weight228.23 g/mol
Exact Mass228.07
IUPAC Name3-(4-fluorophenyl)-1H-indazol-5-ol
SMILESOc1ccc2[nH]nc(-c3ccc(F)cc3)c2c1
InChIInChI=1S/C13H9FN2O/c14-9-3-1-8(2-4-9)13-11-7-10(17)5-6-12(11)15-16-13/h1-7,17H,(H,15,16)
InChIKeyBFGGFCYAPPKBJD-UHFFFAOYSA-N
XLogP3.07
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.23
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-1H-indazol-5-ol?
The IUPAC name of 3-(4-fluorophenyl)-1H-indazol-5-ol (CID 71152082) is 3-(4-fluorophenyl)-1H-indazol-5-ol.
What is the SMILES notation for 3-(4-fluorophenyl)-1H-indazol-5-ol?
The canonical SMILES for 3-(4-fluorophenyl)-1H-indazol-5-ol is Oc1ccc2[nH]nc(-c3ccc(F)cc3)c2c1.
What is the InChIKey of 3-(4-fluorophenyl)-1H-indazol-5-ol?
The InChIKey is BFGGFCYAPPKBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2O/c14-9-3-1-8(2-4-9)13-11-7-10(17)5-6-12(11)15-16-13/h1-7,17H,(H,15,16).
What are the key properties of 3-(4-fluorophenyl)-1H-indazol-5-ol?
3-(4-fluorophenyl)-1H-indazol-5-ol has a molecular weight of 228.23 g/mol, XLogP of 3.07, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-1H-indazol-5-ol is sourced from PubChem (CID 71152082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).