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

C16H11F3N2O2S2 — CID 2815476

IUPAC5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccccc1C(F)(F)F)c1ccc(-c2ccccn2)s1
InChIInChI=1S/C16H11F3N2O2S2/c17-16(18,19)11-5-1-2-6-12(11)21-25(22,23)15-9-8-14(24-15)13-7-3-4-10-20-13/h1-10,21H
InChIKeyYXUVRMWHTFLFMW-UHFFFAOYSA-N
MW384.40 g/mol
LogP4.63
Rot. Bonds4

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

5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide (PubChem CID 2815476) has the molecular formula C16H11F3N2O2S2 and a molecular weight of 384.40 g/mol. Its IUPAC name is 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
PubChem CID2815476
Molecular FormulaC16H11F3N2O2S2
Molecular Weight384.40 g/mol
Exact Mass384.02
IUPAC Name5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccccc1C(F)(F)F)c1ccc(-c2ccccn2)s1
InChIInChI=1S/C16H11F3N2O2S2/c17-16(18,19)11-5-1-2-6-12(11)21-25(22,23)15-9-8-14(24-15)13-7-3-4-10-20-13/h1-10,21H
InChIKeyYXUVRMWHTFLFMW-UHFFFAOYSA-N
XLogP4.63
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.40
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide (CID 2815476) is 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide is O=S(=O)(Nc1ccccc1C(F)(F)F)c1ccc(-c2ccccn2)s1.
What is the InChIKey of 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
The InChIKey is YXUVRMWHTFLFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F3N2O2S2/c17-16(18,19)11-5-1-2-6-12(11)21-25(22,23)15-9-8-14(24-15)13-7-3-4-10-20-13/h1-10,21H.
What are the key properties of 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide?
5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide has a molecular weight of 384.40 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 2815476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).