N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide

C11H7ClF3NO2S2 — CID 971753

IUPACN-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cc(C(F)(F)F)ccc1Cl)c1cccs1
InChIInChI=1S/C11H7ClF3NO2S2/c12-8-4-3-7(11(13,14)15)6-9(8)16-20(17,18)10-2-1-5-19-10/h1-6,16H
InChIKeyLKANVMMIVMKKDG-UHFFFAOYSA-N
MW341.76 g/mol
LogP4.22
Rot. Bonds3

About N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide

N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide (PubChem CID 971753) has the molecular formula C11H7ClF3NO2S2 and a molecular weight of 341.76 g/mol. Its IUPAC name is N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
PubChem CID971753
Molecular FormulaC11H7ClF3NO2S2
Molecular Weight341.76 g/mol
Exact Mass340.96
IUPAC NameN-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cc(C(F)(F)F)ccc1Cl)c1cccs1
InChIInChI=1S/C11H7ClF3NO2S2/c12-8-4-3-7(11(13,14)15)6-9(8)16-20(17,18)10-2-1-5-19-10/h1-6,16H
InChIKeyLKANVMMIVMKKDG-UHFFFAOYSA-N
XLogP4.22
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.76
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-2-chlorophenyl)thiophene-2-sulfonamide
CID 55132063
N-[2-cyano-4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CID 115911312
N-(2-chloro-5-sulfamoylphenyl)thiophene-2-sulfonamide
CID 61132271
N-[3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-2-pyridinyl]thiophene-2-sulfonamide
CID 57382886
N-(5-tert-butyl-2-hydroxyphenyl)thiophene-2-sulfonamide
CID 43398038
N-[4,5-dichloro-2-[(2,5-dichlorophenyl)sulfonylamino]phenyl]thiophene-2-sulfonamide
CID 67970539
N-[2-chloro-5-(trifluoromethyl)phenyl]-4-methoxy-3-methylbenzenesulfonamide
CID 5162311
2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]ethanesulfonamide
CID 113220712
4-bromo-N-[2-chloro-5-(trifluoromethyl)phenyl]-2,5-dimethylbenzenesulfonamide
CID 165435692
N-[4,5-dichloro-2-[(3-chloro-4-methylphenyl)sulfonylamino]phenyl]thiophene-2-sulfonamide
CID 67970049
N-[4-fluoro-2-(thiophen-2-ylsulfonylamino)phenyl]thiophene-2-sulfonamide
CID 70133210
N-[3,4-bis(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CID 2474123

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide (CID 971753) is N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide is O=S(=O)(Nc1cc(C(F)(F)F)ccc1Cl)c1cccs1.
What is the InChIKey of N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The InChIKey is LKANVMMIVMKKDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClF3NO2S2/c12-8-4-3-7(11(13,14)15)6-9(8)16-20(17,18)10-2-1-5-19-10/h1-6,16H.
What are the key properties of N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide has a molecular weight of 341.76 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(trifluoromethyl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 971753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).