2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone

C15H13FO2S — CID 64637840

IUPAC2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone
SMILESCc1ccccc1C(=O)CS(=O)c1ccccc1F
InChIInChI=1S/C15H13FO2S/c1-11-6-2-3-7-12(11)14(17)10-19(18)15-9-5-4-8-13(15)16/h2-9H,10H2,1H3
InChIKeyHNIGBGQXXLZLJS-UHFFFAOYSA-N
MW276.33 g/mol
LogP3.12
Rot. Bonds4

About 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone

2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone (PubChem CID 64637840) has the molecular formula C15H13FO2S and a molecular weight of 276.33 g/mol. Its IUPAC name is 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone
PubChem CID64637840
Molecular FormulaC15H13FO2S
Molecular Weight276.33 g/mol
Exact Mass276.06
IUPAC Name2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone
SMILESCc1ccccc1C(=O)CS(=O)c1ccccc1F
InChIInChI=1S/C15H13FO2S/c1-11-6-2-3-7-12(11)14(17)10-19(18)15-9-5-4-8-13(15)16/h2-9H,10H2,1H3
InChIKeyHNIGBGQXXLZLJS-UHFFFAOYSA-N
XLogP3.12
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.33
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone
CID 64636301
1-(3,4-dimethylphenyl)-2-(2-fluorophenyl)sulfinylethanone
CID 64637654
1-(2,5-difluorophenyl)-2-(2-methylphenyl)sulfinylethanone
CID 64638732
2-(2-fluorophenyl)sulfinyl-1-(2-methoxy-4-methylphenyl)ethanone
CID 64636678
2-(2-fluorophenyl)sulfinyl-1-(5-methylthiophen-2-yl)ethanone
CID 64636680
1-(2-methylphenyl)-2-(4-methylphenyl)sulfinylethanone
CID 12729207
1-(2,4-dimethylphenyl)-2-(2-methylphenyl)sulfinylethanone
CID 64639745
2-(2-methylphenyl)sulfinyl-1-(2,4,5-trimethylphenyl)ethanone
CID 64638938
1-(1-benzofuran-3-yl)-2-(2-fluorophenyl)sulfinylethanone
CID 64637839
1-cyclopropyl-2-(2-fluorophenyl)sulfinylethanone
CID 64635571
N-(5-amino-2-methylphenyl)-2-(2-fluorophenyl)sulfinylacetamide
CID 61302033
2-(2,5-difluorophenyl)sulfinyl-1-(2-methoxyphenyl)ethanone
CID 64638325

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone?
The IUPAC name of 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone (CID 64637840) is 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone.
What is the SMILES notation for 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone?
The canonical SMILES for 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone is Cc1ccccc1C(=O)CS(=O)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone?
The InChIKey is HNIGBGQXXLZLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO2S/c1-11-6-2-3-7-12(11)14(17)10-19(18)15-9-5-4-8-13(15)16/h2-9H,10H2,1H3.
What are the key properties of 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone?
2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone has a molecular weight of 276.33 g/mol, XLogP of 3.12, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)sulfinyl-1-(2-methylphenyl)ethanone is sourced from PubChem (CID 64637840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).