1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone

C11H11FO2S — CID 64635571

IUPAC1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone
SMILESO=C(CS(=O)c1ccccc1F)C1CC1
InChIInChI=1S/C11H11FO2S/c12-9-3-1-2-4-11(9)15(14)7-10(13)8-5-6-8/h1-4,8H,5-7H2
InChIKeyQRLDZMFVXQQSAW-UHFFFAOYSA-N
MW226.27 g/mol
LogP1.91
Rot. Bonds4

About 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone

1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone (PubChem CID 64635571) has the molecular formula C11H11FO2S and a molecular weight of 226.27 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone.

Molecular Properties

Compound Name1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone
PubChem CID64635571
Molecular FormulaC11H11FO2S
Molecular Weight226.27 g/mol
Exact Mass226.05
IUPAC Name1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone
SMILESO=C(CS(=O)c1ccccc1F)C1CC1
InChIInChI=1S/C11H11FO2S/c12-9-3-1-2-4-11(9)15(14)7-10(13)8-5-6-8/h1-4,8H,5-7H2
InChIKeyQRLDZMFVXQQSAW-UHFFFAOYSA-N
XLogP1.91
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone 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

1-cyclopentyl-2-(2-fluorophenyl)sulfinylethanone
CID 104756239
2-(benzenesulfinyl)-1-cyclopropylethanone
CID 64637996
1-(azepan-1-yl)-2-(2-fluorophenyl)sulfinylethanone
CID 63793169
N-cyclohexyl-2-(2-fluorophenyl)sulfinylacetamide
CID 63792281
1-cyclohexyl-2-(2-methylphenyl)sulfinylethanone
CID 113449628
2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone
CID 64637840
1-cyclopropyl-2-(2,4-dimethylphenyl)sulfinylethanone
CID 64637629
1-(3,4-dimethylphenyl)-2-(2-fluorophenyl)sulfinylethanone
CID 64637654
2-(2-fluorophenyl)sulfinyl-1-(5-methylthiophen-2-yl)ethanone
CID 64636680
2-[(2-fluorophenyl)sulfinylmethyl]oxirane
CID 115474734
1-cyclopropyl-3-(2-fluorophenyl)propan-1-one
CID 63351757
1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanamine
CID 64657955

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone?
The IUPAC name of 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone (CID 64635571) is 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone.
What is the SMILES notation for 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone?
The canonical SMILES for 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone is O=C(CS(=O)c1ccccc1F)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone?
The InChIKey is QRLDZMFVXQQSAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FO2S/c12-9-3-1-2-4-11(9)15(14)7-10(13)8-5-6-8/h1-4,8H,5-7H2.
What are the key properties of 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone?
1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone has a molecular weight of 226.27 g/mol, XLogP of 1.91, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone is sourced from PubChem (CID 64635571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).