1-(6-fluoro-3-hydroxyindol-1-yl)ethanone

C10H8FNO2 — CID 24802133

IUPAC1-(6-fluoro-3-hydroxyindol-1-yl)ethanone
SMILESCC(=O)n1cc(O)c2ccc(F)cc21
InChIInChI=1S/C10H8FNO2/c1-6(13)12-5-10(14)8-3-2-7(11)4-9(8)12/h2-5,14H,1H3
InChIKeyUJLQOJWLQAMJCH-UHFFFAOYSA-N
MW193.18 g/mol
LogP2.15
Rot. Bonds

About 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone

1-(6-fluoro-3-hydroxyindol-1-yl)ethanone (PubChem CID 24802133) has the molecular formula C10H8FNO2 and a molecular weight of 193.18 g/mol. Its IUPAC name is 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone.

Molecular Properties

Compound Name1-(6-fluoro-3-hydroxyindol-1-yl)ethanone
PubChem CID24802133
Molecular FormulaC10H8FNO2
Molecular Weight193.18 g/mol
Exact Mass193.05
IUPAC Name1-(6-fluoro-3-hydroxyindol-1-yl)ethanone
SMILESCC(=O)n1cc(O)c2ccc(F)cc21
InChIInChI=1S/C10H8FNO2/c1-6(13)12-5-10(14)8-3-2-7(11)4-9(8)12/h2-5,14H,1H3
InChIKeyUJLQOJWLQAMJCH-UHFFFAOYSA-N
XLogP2.15
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone?
The IUPAC name of 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone (CID 24802133) is 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone.
What is the SMILES notation for 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone?
The canonical SMILES for 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone is CC(=O)n1cc(O)c2ccc(F)cc21.
What is the InChIKey of 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone?
The InChIKey is UJLQOJWLQAMJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO2/c1-6(13)12-5-10(14)8-3-2-7(11)4-9(8)12/h2-5,14H,1H3.
What are the key properties of 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone?
1-(6-fluoro-3-hydroxyindol-1-yl)ethanone has a molecular weight of 193.18 g/mol, XLogP of 2.15, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-3-hydroxyindol-1-yl)ethanone is sourced from PubChem (CID 24802133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).