N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide

C14H19FN2O3S — CID 114545154

IUPACN-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NC2CCC(C)C2)c(F)c1
InChIInChI=1S/C14H19FN2O3S/c1-9-3-4-12(7-9)17-21(19,20)14-6-5-11(8-13(14)15)16-10(2)18/h5-6,8-9,12,17H,3-4,7H2,1-2H3,(H,16,18)
InChIKeyPMOCRINJKOSACE-UHFFFAOYSA-N
MW314.38 g/mol
LogP2.25
Rot. Bonds4

About N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide

N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide (PubChem CID 114545154) has the molecular formula C14H19FN2O3S and a molecular weight of 314.38 g/mol. Its IUPAC name is N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide
PubChem CID114545154
Molecular FormulaC14H19FN2O3S
Molecular Weight314.38 g/mol
Exact Mass314.11
IUPAC NameN-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NC2CCC(C)C2)c(F)c1
InChIInChI=1S/C14H19FN2O3S/c1-9-3-4-12(7-9)17-21(19,20)14-6-5-11(8-13(14)15)16-10(2)18/h5-6,8-9,12,17H,3-4,7H2,1-2H3,(H,16,18)
InChIKeyPMOCRINJKOSACE-UHFFFAOYSA-N
XLogP2.25
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]benzoic acid
CID 114543676
3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]benzenesulfonyl chloride
CID 114546471
5-amino-2,4-difluoro-N-(3-methylcyclopentyl)benzenesulfonamide
CID 114542830
3-fluoro-4-[(4-methylcyclohexyl)sulfamoyl]benzoic acid
CID 79180239
3-fluoro-4-methyl-5-[(3-methylcyclopentyl)sulfamoyl]benzoic acid
CID 114543620
4-amino-N-(3,5-dimethylcyclohexyl)-2-fluorobenzenesulfonamide
CID 64732843
2,6-difluoro-N-(3-methylcyclopentyl)benzenesulfonamide
CID 114545218
2-fluoro-4-(methylaminomethyl)-N-(3-methylcyclohexyl)benzenesulfonamide
CID 106027547
(2S)-2-[(4-acetamido-2-fluorophenyl)sulfonylamino]-3-cyclopropylpropanoic acid
CID 154742047
N-[4-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]sulfonyl-3-fluorophenyl]acetamide
CID 79410911
3-fluoro-4-methyl-N-(3-methylcyclopentyl)benzenesulfonamide
CID 114545307
N-[3-fluoro-4-[[(2S)-1-hydroxy-3-methylbutan-2-yl]sulfamoyl]phenyl]acetamide
CID 79246647

Frequently Asked Questions

What is the IUPAC name of N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide (CID 114545154) is N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)NC2CCC(C)C2)c(F)c1.
What is the InChIKey of N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide?
The InChIKey is PMOCRINJKOSACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O3S/c1-9-3-4-12(7-9)17-21(19,20)14-6-5-11(8-13(14)15)16-10(2)18/h5-6,8-9,12,17H,3-4,7H2,1-2H3,(H,16,18).
What are the key properties of N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide?
N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide has a molecular weight of 314.38 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-fluoro-4-[(3-methylcyclopentyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 114545154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).