N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide

C16H17FN2O3S — CID 24592548

IUPACN-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
SMILESCC(C)NS(=O)(=O)c1ccc(C(=O)Nc2ccccc2F)cc1
InChIInChI=1S/C16H17FN2O3S/c1-11(2)19-23(21,22)13-9-7-12(8-10-13)16(20)18-15-6-4-3-5-14(15)17/h3-11,19H,1-2H3,(H,18,20)
InChIKeyMRSBQRQLNFXAAE-UHFFFAOYSA-N
MW336.39 g/mol
LogP2.76
Rot. Bonds5

About N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide

N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide (PubChem CID 24592548) has the molecular formula C16H17FN2O3S and a molecular weight of 336.39 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
PubChem CID24592548
Molecular FormulaC16H17FN2O3S
Molecular Weight336.39 g/mol
Exact Mass336.09
IUPAC NameN-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
SMILESCC(C)NS(=O)(=O)c1ccc(C(=O)Nc2ccccc2F)cc1
InChIInChI=1S/C16H17FN2O3S/c1-11(2)19-23(21,22)13-9-7-12(8-10-13)16(20)18-15-6-4-3-5-14(15)17/h3-11,19H,1-2H3,(H,18,20)
InChIKeyMRSBQRQLNFXAAE-UHFFFAOYSA-N
XLogP2.76
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 ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-difluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 51309792
4-(propan-2-ylsulfamoyl)-N-(2,3,4-trifluorophenyl)benzamide
CID 16591110
N-(2-acetylphenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 16592625
4-[(2,6-dimethylphenyl)sulfamoyl]-N-(2-fluorophenyl)benzamide
CID 109061758
4-(difluoromethylsulfonyl)-N-(2-fluorophenyl)benzamide
CID 8780386
2-[(4-acetylphenyl)sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 110408013
N-(2-fluorophenyl)-4-(prop-2-ynylsulfamoyl)benzamide
CID 33314164
N-[(2-fluorophenyl)methyl]-4-(propan-2-ylsulfamoyl)benzamide
CID 26887031
N-[2-(azepan-1-yl)phenyl]-4-(propan-2-ylsulfamoyl)benzamide
CID 38282657
2-[[4-(propan-2-ylsulfamoyl)benzoyl]amino]-N-(2,2,2-trifluoroethyl)benzamide
CID 55492050
4-[(2-fluorophenyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide
CID 46651101
4-N-(2-fluorophenyl)-1-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109049811

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The IUPAC name of N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide (CID 24592548) is N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide.
What is the SMILES notation for N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The canonical SMILES for N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide is CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2ccccc2F)cc1.
What is the InChIKey of N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide?
The InChIKey is MRSBQRQLNFXAAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O3S/c1-11(2)19-23(21,22)13-9-7-12(8-10-13)16(20)18-15-6-4-3-5-14(15)17/h3-11,19H,1-2H3,(H,18,20).
What are the key properties of N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide?
N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide has a molecular weight of 336.39 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4-(propan-2-ylsulfamoyl)benzamide is sourced from PubChem (CID 24592548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).