2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone

C13H11FOS — CID 65099356

IUPAC2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone
SMILESCc1cc(C(=O)Cc2ccccc2F)cs1
InChIInChI=1S/C13H11FOS/c1-9-6-11(8-16-9)13(15)7-10-4-2-3-5-12(10)14/h2-6,8H,7H2,1H3
InChIKeyUOOYYYPUWSCLLF-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.62
Rot. Bonds3

About 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone

2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone (PubChem CID 65099356) has the molecular formula C13H11FOS and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone.

Molecular Properties

Compound Name2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone
PubChem CID65099356
Molecular FormulaC13H11FOS
Molecular Weight234.30 g/mol
Exact Mass234.05
IUPAC Name2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone
SMILESCc1cc(C(=O)Cc2ccccc2F)cs1
InChIInChI=1S/C13H11FOS/c1-9-6-11(8-16-9)13(15)7-10-4-2-3-5-12(10)14/h2-6,8H,7H2,1H3
InChIKeyUOOYYYPUWSCLLF-UHFFFAOYSA-N
XLogP3.62
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone with MolForge

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

Launch Full Analysis

Related Compounds

2-(3-chloro-2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone
CID 82802930
2-(2-fluorophenyl)-1-thiophen-3-ylethanone
CID 60799392
2-(3-methylphenyl)-1-(5-methylthiophen-3-yl)ethanone
CID 65099524
1-(5-methylthiophen-3-yl)-2-pyridin-4-ylethanone
CID 58514854
2-(2-fluorophenyl)-1-(4-methylthiophen-3-yl)ethanone
CID 79803188
1-(4-bromo-5-methylthiophen-2-yl)-2-(2-fluorophenyl)ethanone
CID 102826498
1-(3-bromo-4-chlorophenyl)-2-(2-fluorophenyl)ethanone
CID 115565954
2-(2-fluorophenyl)-1-(4-methyl-1,3-thiazol-5-yl)ethanone
CID 105079227
2-(2-fluorophenyl)-1-(4-propylphenyl)ethanone
CID 43338005
1-(2,5-dimethylphenyl)-2-(2-fluorophenyl)ethanone
CID 43337245
2-(2-fluorophenyl)-1-[3-(2-methylpropyl)phenyl]ethanone
CID 116543144
carbonic acid;1-ethyl-2-fluorobenzene
CID 174964119

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone?
The IUPAC name of 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone (CID 65099356) is 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone.
What is the SMILES notation for 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone?
The canonical SMILES for 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone is Cc1cc(C(=O)Cc2ccccc2F)cs1.
What is the InChIKey of 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone?
The InChIKey is UOOYYYPUWSCLLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FOS/c1-9-6-11(8-16-9)13(15)7-10-4-2-3-5-12(10)14/h2-6,8H,7H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone?
2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone has a molecular weight of 234.30 g/mol, XLogP of 3.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-1-(5-methylthiophen-3-yl)ethanone is sourced from PubChem (CID 65099356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).