N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide

C15H14ClFN2O3S — CID 4250932

IUPACN-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide
SMILESCN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)c2cccc(F)c2)c1
InChIInChI=1S/C15H14ClFN2O3S/c1-19(2)23(21,22)12-6-7-13(16)14(9-12)18-15(20)10-4-3-5-11(17)8-10/h3-9H,1-2H3,(H,18,20)
InChIKeyUDICIQCSLSIGEQ-UHFFFAOYSA-N
MW356.81 g/mol
LogP2.98
Rot. Bonds4

About N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide

N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide (PubChem CID 4250932) has the molecular formula C15H14ClFN2O3S and a molecular weight of 356.81 g/mol. Its IUPAC name is N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide.

Molecular Properties

Compound NameN-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide
PubChem CID4250932
Molecular FormulaC15H14ClFN2O3S
Molecular Weight356.81 g/mol
Exact Mass356.04
IUPAC NameN-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide
SMILESCN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)c2cccc(F)c2)c1
InChIInChI=1S/C15H14ClFN2O3S/c1-19(2)23(21,22)12-6-7-13(16)14(9-12)18-15(20)10-4-3-5-11(17)8-10/h3-9H,1-2H3,(H,18,20)
InChIKeyUDICIQCSLSIGEQ-UHFFFAOYSA-N
XLogP2.98
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-fluorophenyl)-3-(dimethylsulfamoyl)benzamide
CID 2664609
N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-4-cyanobenzamide
CID 5218436
N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-oxo-3-phenylpropanamide
CID 21339599
2-chloro-5-(dimethylsulfamoyl)-N-(5-fluoro-2-methylphenyl)benzamide
CID 4650179
2-chloro-N-(2-chlorophenyl)-5-(dimethylsulfamoyl)benzamide
CID 1310418
3-(dimethylsulfamoyl)-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 55341476
2-chloro-N-[5-(dimethylsulfamoyl)-2-methylphenyl]-4-fluorobenzamide
CID 26522089
N-(2-chloro-4-fluorophenyl)-3-[methoxy(methyl)sulfamoyl]benzamide
CID 51204944
N-(2-chloro-5-methylsulfonylphenyl)-3-methylbenzamide
CID 8913728
3-fluoro-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 4155198
N-(2-chloro-5-methylsulfonylphenyl)benzamide
CID 8913636
N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-1,3-thiazole-4-carboxamide
CID 63047654

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide?
The IUPAC name of N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide (CID 4250932) is N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide.
What is the SMILES notation for N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide?
The canonical SMILES for N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide is CN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)c2cccc(F)c2)c1.
What is the InChIKey of N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide?
The InChIKey is UDICIQCSLSIGEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O3S/c1-19(2)23(21,22)12-6-7-13(16)14(9-12)18-15(20)10-4-3-5-11(17)8-10/h3-9H,1-2H3,(H,18,20).
What are the key properties of N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide?
N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide has a molecular weight of 356.81 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-3-fluorobenzamide is sourced from PubChem (CID 4250932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).