5-fluoro-1-benzothiophene

C8H5FS — CID 11815950

IUPAC5-fluoro-1-benzothiophene
SMILESFc1ccc2sccc2c1
InChIInChI=1S/C8H5FS/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H
InChIKeyVKBPSLNJNKFVAC-UHFFFAOYSA-N
MW152.19 g/mol
LogP3.04
Rot. Bonds

About 5-fluoro-1-benzothiophene

5-fluoro-1-benzothiophene (PubChem CID 11815950) has the molecular formula C8H5FS and a molecular weight of 152.19 g/mol. Its IUPAC name is 5-fluoro-1-benzothiophene.

Molecular Properties

Compound Name5-fluoro-1-benzothiophene
PubChem CID11815950
Molecular FormulaC8H5FS
Molecular Weight152.19 g/mol
Exact Mass152.01
IUPAC Name5-fluoro-1-benzothiophene
SMILESFc1ccc2sccc2c1
InChIInChI=1S/C8H5FS/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H
InChIKeyVKBPSLNJNKFVAC-UHFFFAOYSA-N
XLogP3.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.19
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-fluoro-1-benzothiophene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-benzothiophene?
The IUPAC name of 5-fluoro-1-benzothiophene (CID 11815950) is 5-fluoro-1-benzothiophene.
What is the SMILES notation for 5-fluoro-1-benzothiophene?
The canonical SMILES for 5-fluoro-1-benzothiophene is Fc1ccc2sccc2c1.
What is the InChIKey of 5-fluoro-1-benzothiophene?
The InChIKey is VKBPSLNJNKFVAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FS/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H.
What are the key properties of 5-fluoro-1-benzothiophene?
5-fluoro-1-benzothiophene has a molecular weight of 152.19 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-benzothiophene is sourced from PubChem (CID 11815950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).