5-fluoro-1-hydroxyindole

C8H6FNO — CID 13415513

IUPAC5-fluoro-1-hydroxyindole
SMILESOn1ccc2cc(F)ccc21
InChIInChI=1S/C8H6FNO/c9-7-1-2-8-6(5-7)3-4-10(8)11/h1-5,11H
InChIKeyZIIMOKUHFYBIRY-UHFFFAOYSA-N
MW151.14 g/mol
LogP2.02
Rot. Bonds

About 5-fluoro-1-hydroxyindole

5-fluoro-1-hydroxyindole (PubChem CID 13415513) has the molecular formula C8H6FNO and a molecular weight of 151.14 g/mol. Its IUPAC name is 5-fluoro-1-hydroxyindole.

Molecular Properties

Compound Name5-fluoro-1-hydroxyindole
PubChem CID13415513
Molecular FormulaC8H6FNO
Molecular Weight151.14 g/mol
Exact Mass151.04
IUPAC Name5-fluoro-1-hydroxyindole
SMILESOn1ccc2cc(F)ccc21
InChIInChI=1S/C8H6FNO/c9-7-1-2-8-6(5-7)3-4-10(8)11/h1-5,11H
InChIKeyZIIMOKUHFYBIRY-UHFFFAOYSA-N
XLogP2.02
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-hydroxyindole?
The IUPAC name of 5-fluoro-1-hydroxyindole (CID 13415513) is 5-fluoro-1-hydroxyindole.
What is the SMILES notation for 5-fluoro-1-hydroxyindole?
The canonical SMILES for 5-fluoro-1-hydroxyindole is On1ccc2cc(F)ccc21.
What is the InChIKey of 5-fluoro-1-hydroxyindole?
The InChIKey is ZIIMOKUHFYBIRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FNO/c9-7-1-2-8-6(5-7)3-4-10(8)11/h1-5,11H.
What are the key properties of 5-fluoro-1-hydroxyindole?
5-fluoro-1-hydroxyindole has a molecular weight of 151.14 g/mol, XLogP of 2.02, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-hydroxyindole is sourced from PubChem (CID 13415513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).