N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide

C16H16F2N2O3S — CID 51309792

IUPACN-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
SMILESCC(C)NS(=O)(=O)c1ccc(C(=O)Nc2c(F)cccc2F)cc1
InChIInChI=1S/C16H16F2N2O3S/c1-10(2)20-24(22,23)12-8-6-11(7-9-12)16(21)19-15-13(17)4-3-5-14(15)18/h3-10,20H,1-2H3,(H,19,21)
InChIKeyDQHIDZKUSQTXNC-UHFFFAOYSA-N
MW354.38 g/mol
LogP2.90
Rot. Bonds5

About N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide

N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide (PubChem CID 51309792) has the molecular formula C16H16F2N2O3S and a molecular weight of 354.38 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
PubChem CID51309792
Molecular FormulaC16H16F2N2O3S
Molecular Weight354.38 g/mol
Exact Mass354.08
IUPAC NameN-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
SMILESCC(C)NS(=O)(=O)c1ccc(C(=O)Nc2c(F)cccc2F)cc1
InChIInChI=1S/C16H16F2N2O3S/c1-10(2)20-24(22,23)12-8-6-11(7-9-12)16(21)19-15-13(17)4-3-5-14(15)18/h3-10,20H,1-2H3,(H,19,21)
InChIKeyDQHIDZKUSQTXNC-UHFFFAOYSA-N
XLogP2.90
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(butan-2-ylsulfamoyl)-N-(2,6-difluorophenyl)benzamide
CID 55485773
N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 24592548
N-[(2-fluorophenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide
CID 26887031
4-(propan-2-ylsulfamoyl)-N-(2,3,4-trifluorophenyl)benzamide
CID 16591110
4-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 4924513
N-(4-acetamidophenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 27648936
N-(2,6-difluorophenyl)-4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]benzamide
CID 109061835
N-(2-acetylphenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 16592625
2-[(4-bromophenyl)sulfonylamino]-N-(2,6-difluorophenyl)propanamide
CID 3652587
4-[(2,6-dimethylphenyl)sulfamoyl]-N-(2-fluorophenyl)benzamide
CID 109061758
N-cyclohexyl-4-[(2,6-difluorophenyl)sulfamoyl]benzamide
CID 109059522
N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 25400706

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The IUPAC name of N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide (CID 51309792) is N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The canonical SMILES for N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide is CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2c(F)cccc2F)cc1.
What is the InChIKey of N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The InChIKey is DQHIDZKUSQTXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2O3S/c1-10(2)20-24(22,23)12-8-6-11(7-9-12)16(21)19-15-13(17)4-3-5-14(15)18/h3-10,20H,1-2H3,(H,19,21).
What are the key properties of N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide?
N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide has a molecular weight of 354.38 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide is sourced from PubChem (CID 51309792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).