N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide

C11H8F3NO2S2 — CID 970857

IUPACN-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccs1
InChIInChI=1S/C11H8F3NO2S2/c12-11(13,14)8-3-5-9(6-4-8)15-19(16,17)10-2-1-7-18-10/h1-7,15H
InChIKeyCLAKDQAHAINKMS-UHFFFAOYSA-N
MW307.32 g/mol
LogP3.57
Rot. Bonds3

About N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide

N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide (PubChem CID 970857) has the molecular formula C11H8F3NO2S2 and a molecular weight of 307.32 g/mol. Its IUPAC name is N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
PubChem CID970857
Molecular FormulaC11H8F3NO2S2
Molecular Weight307.32 g/mol
Exact Mass306.99
IUPAC NameN-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccs1
InChIInChI=1S/C11H8F3NO2S2/c12-11(13,14)8-3-5-9(6-4-8)15-19(16,17)10-2-1-7-18-10/h1-7,15H
InChIKeyCLAKDQAHAINKMS-UHFFFAOYSA-N
XLogP3.57
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.32
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide (CID 970857) is N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide is O=S(=O)(Nc1ccc(C(F)(F)F)cc1)c1cccs1.
What is the InChIKey of N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The InChIKey is CLAKDQAHAINKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3NO2S2/c12-11(13,14)8-3-5-9(6-4-8)15-19(16,17)10-2-1-7-18-10/h1-7,15H.
What are the key properties of N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide has a molecular weight of 307.32 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(trifluoromethyl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 970857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).