N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide

C15H14FNO3S — CID 110771361

IUPACN-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide
SMILESCS(=O)(=O)c1ccc(CC(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C15H14FNO3S/c1-21(19,20)14-7-5-11(6-8-14)9-15(18)17-13-4-2-3-12(16)10-13/h2-8,10H,9H2,1H3,(H,17,18)
InChIKeyRTQSIXCYAAWCET-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.41
Rot. Bonds4

About N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide

N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide (PubChem CID 110771361) has the molecular formula C15H14FNO3S and a molecular weight of 307.35 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide
PubChem CID110771361
Molecular FormulaC15H14FNO3S
Molecular Weight307.35 g/mol
Exact Mass307.07
IUPAC NameN-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide
SMILESCS(=O)(=O)c1ccc(CC(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C15H14FNO3S/c1-21(19,20)14-7-5-11(6-8-14)9-15(18)17-13-4-2-3-12(16)10-13/h2-8,10H,9H2,1H3,(H,17,18)
InChIKeyRTQSIXCYAAWCET-UHFFFAOYSA-N
XLogP2.41
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide
CID 71283763
2-(4-ethoxyphenyl)-N-(3-fluorophenyl)acetamide
CID 26579486
N-[2-(3-fluoroanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 49335487
2-(3-fluoroanilino)-1-(4-methylsulfonylphenyl)ethanone
CID 102007903
N-(3-chloro-4-methylphenyl)-2-(4-methylsulfonylphenyl)acetamide
CID 110771339
2-(4-ethoxyphenyl)-N-(3-methylsulfonylphenyl)acetamide
CID 27334833
N-(4-ethylphenyl)-N'-(3-fluorophenyl)propanediamide
CID 108954059
N-(3-fluorophenyl)-2-methyl-5-methylsulfonylbenzamide
CID 9412429
N-(3-fluorophenyl)-3-[(4-fluorophenyl)sulfonylamino]propanamide
CID 17192108
N-(4-bromo-3-chlorophenyl)-2-(4-methylsulfonylphenyl)acetamide
CID 71284029
N-(3-fluorophenyl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetamide
CID 39267237
2-[ethyl-[(3-fluorophenyl)methyl]amino]-N-(4-methylsulfonylphenyl)acetamide
CID 17443267

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide (CID 110771361) is N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide is CS(=O)(=O)c1ccc(CC(=O)Nc2cccc(F)c2)cc1.
What is the InChIKey of N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide?
The InChIKey is RTQSIXCYAAWCET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3S/c1-21(19,20)14-7-5-11(6-8-14)9-15(18)17-13-4-2-3-12(16)10-13/h2-8,10H,9H2,1H3,(H,17,18).
What are the key properties of N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide?
N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide has a molecular weight of 307.35 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide is sourced from PubChem (CID 110771361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).