2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide

C16H17FN2O3S — CID 9107367

IUPAC2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
SMILESCNS(=O)(=O)c1cc(NC(=O)Cc2cccc(F)c2)ccc1C
InChIInChI=1S/C16H17FN2O3S/c1-11-6-7-14(10-15(11)23(21,22)18-2)19-16(20)9-12-4-3-5-13(17)8-12/h3-8,10,18H,9H2,1-2H3,(H,19,20)
InChIKeyNQYQXACICOXGAH-UHFFFAOYSA-N
MW336.39 g/mol
LogP2.22
Rot. Bonds5

About 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide

2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide (PubChem CID 9107367) has the molecular formula C16H17FN2O3S and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
PubChem CID9107367
Molecular FormulaC16H17FN2O3S
Molecular Weight336.39 g/mol
Exact Mass336.09
IUPAC Name2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
SMILESCNS(=O)(=O)c1cc(NC(=O)Cc2cccc(F)c2)ccc1C
InChIInChI=1S/C16H17FN2O3S/c1-11-6-7-14(10-15(11)23(21,22)18-2)19-16(20)9-12-4-3-5-13(17)8-12/h3-8,10,18H,9H2,1-2H3,(H,19,20)
InChIKeyNQYQXACICOXGAH-UHFFFAOYSA-N
XLogP2.22
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dimethylphenyl)-2-(3-fluorophenyl)acetamide
CID 8743428
2-(3,4-dichlorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
CID 9107151
2-(2-chlorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
CID 9107371
3-amino-N-[4-methyl-3-(methylsulfamoyl)phenyl]propanamide;hydrochloride
CID 119270679
N-[3-[[2-(3-fluorophenyl)acetyl]amino]-4-methylphenyl]propanamide
CID 46467166
2-(2-methoxyphenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
CID 9106782
N-[4-(butylamino)phenyl]-2-(3-fluorophenyl)acetamide
CID 112980257
2-[3-(dimethylsulfamoyl)-4-methylanilino]-N-(3-fluorophenyl)acetamide
CID 9100777
2-(2-methyl-1H-indol-3-yl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
CID 31996620
N-[4-methyl-3-(methylsulfamoyl)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 36677114
N-(3-amino-4-ethylphenyl)-2-(3-fluorophenyl)acetamide
CID 43550262
[2-[4-methyl-3-(methylsulfamoyl)anilino]-2-oxoethyl] 3-phenylpropanoate
CID 9016360

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide (CID 9107367) is 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide is CNS(=O)(=O)c1cc(NC(=O)Cc2cccc(F)c2)ccc1C.
What is the InChIKey of 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide?
The InChIKey is NQYQXACICOXGAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O3S/c1-11-6-7-14(10-15(11)23(21,22)18-2)19-16(20)9-12-4-3-5-13(17)8-12/h3-8,10,18H,9H2,1-2H3,(H,19,20).
What are the key properties of 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide?
2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide has a molecular weight of 336.39 g/mol, XLogP of 2.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 9107367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).