N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide

C9H11FN2O3S — CID 20553706

IUPACN-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide
SMILESCC(=O)Nc1cc(F)c(S(N)(=O)=O)cc1C
InChIInChI=1S/C9H11FN2O3S/c1-5-3-9(16(11,14)15)7(10)4-8(5)12-6(2)13/h3-4H,1-2H3,(H,12,13)(H2,11,14,15)
InChIKeyZAWJRZZQMFOTEQ-UHFFFAOYSA-N
MW246.26 g/mol
LogP0.74
Rot. Bonds2

About N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide

N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide (PubChem CID 20553706) has the molecular formula C9H11FN2O3S and a molecular weight of 246.26 g/mol. Its IUPAC name is N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide
PubChem CID20553706
Molecular FormulaC9H11FN2O3S
Molecular Weight246.26 g/mol
Exact Mass246.05
IUPAC NameN-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide
SMILESCC(=O)Nc1cc(F)c(S(N)(=O)=O)cc1C
InChIInChI=1S/C9H11FN2O3S/c1-5-3-9(16(11,14)15)7(10)4-8(5)12-6(2)13/h3-4H,1-2H3,(H,12,13)(H2,11,14,15)
InChIKeyZAWJRZZQMFOTEQ-UHFFFAOYSA-N
XLogP0.74
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.26
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-methyl-4-sulfamoyl-5-(trifluoromethyl)phenyl]acetamide
CID 154143738
4-chloro-2-fluoro-5-methylbenzenesulfonamide
CID 71106537
N-(4-acetamido-2,5-difluorophenyl)acetamide
CID 176892585
N-(4,5-dichloro-2-sulfamoylphenyl)acetamide
CID 154352075
N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
CID 47109493
(4-fluoro-2,5-dimethylphenyl)urea
CID 130686270
ethyl 2-(5-bromo-4-fluoro-2-methylanilino)-2-oxoacetate
CID 107593469
N-(4-fluoro-2-methyl-5-phenylphenyl)acetamide
CID 70668820
N-(4,5-difluoro-2-methylphenyl)propanamide
CID 154643466
2-amino-N-(5-bromo-4-fluoro-2-methylphenyl)propanamide
CID 107592265
(2S)-2-amino-N-(5-bromo-4-fluoro-2-methylphenyl)propanamide
CID 107592355
4-acetamido-5-methyl-2-propan-2-ylbenzenesulfonate
CID 177277130

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide?
The IUPAC name of N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide (CID 20553706) is N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide.
What is the SMILES notation for N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide?
The canonical SMILES for N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide is CC(=O)Nc1cc(F)c(S(N)(=O)=O)cc1C.
What is the InChIKey of N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide?
The InChIKey is ZAWJRZZQMFOTEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2O3S/c1-5-3-9(16(11,14)15)7(10)4-8(5)12-6(2)13/h3-4H,1-2H3,(H,12,13)(H2,11,14,15).
What are the key properties of N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide?
N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide has a molecular weight of 246.26 g/mol, XLogP of 0.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methyl-4-sulfamoylphenyl)acetamide is sourced from PubChem (CID 20553706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).