N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide

C11H9ClFNO2S2 — CID 18191076

IUPACN-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)s1
InChIInChI=1S/C11H9ClFNO2S2/c1-7-2-5-11(17-7)18(15,16)14-8-3-4-10(13)9(12)6-8/h2-6,14H,1H3
InChIKeyXYVDFQNYOMDGAF-UHFFFAOYSA-N
MW305.78 g/mol
LogP3.65
Rot. Bonds3

About N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide

N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide (PubChem CID 18191076) has the molecular formula C11H9ClFNO2S2 and a molecular weight of 305.78 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide
PubChem CID18191076
Molecular FormulaC11H9ClFNO2S2
Molecular Weight305.78 g/mol
Exact Mass304.97
IUPAC NameN-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)s1
InChIInChI=1S/C11H9ClFNO2S2/c1-7-2-5-11(17-7)18(15,16)14-8-3-4-10(13)9(12)6-8/h2-6,14H,1H3
InChIKeyXYVDFQNYOMDGAF-UHFFFAOYSA-N
XLogP3.65
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.78
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dichlorophenyl)-5-methylthiophene-2-sulfonamide
CID 18191064
N-(3-chloro-4-fluorophenyl)-5-cyanothiophene-2-sulfonamide
CID 106267208
2-chloro-4-[(5-methylthiophen-2-yl)sulfonylamino]benzoic acid
CID 47390474
N-(3-chloro-4-fluorophenyl)-5-(4,5-dimethyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide
CID 20947584
N-(4-chloro-3-nitrophenyl)-5-methylthiophene-2-sulfonamide
CID 18225962
N-(3-chloro-4-fluorophenyl)-2,5-dimethylbenzenesulfonamide
CID 793232
4-chloro-N-(3-chloro-4-fluorophenyl)-2-fluorobenzenesulfonamide
CID 4849983
N-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-methylthiophene-2-sulfonamide
CID 18092899
5-amino-N-(3-chloro-4-fluorophenyl)-2-fluoro-3-methylbenzenesulfonamide
CID 80629247
N-(3-chloro-4-fluorophenyl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 54930110
3-amino-N-(3-chloro-4-fluorophenyl)-2,5-dimethylbenzenesulfonamide
CID 79885675
N-(3-chloro-4-fluorophenyl)sulfamoyl chloride
CID 84760554

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide (CID 18191076) is N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)s1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide?
The InChIKey is XYVDFQNYOMDGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClFNO2S2/c1-7-2-5-11(17-7)18(15,16)14-8-3-4-10(13)9(12)6-8/h2-6,14H,1H3.
What are the key properties of N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide?
N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide has a molecular weight of 305.78 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide is sourced from PubChem (CID 18191076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).