3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide

C11H8F2N2O2S — CID 142789105

IUPAC3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccccn1)c1cc(F)cc(F)c1
InChIInChI=1S/C11H8F2N2O2S/c12-8-5-9(13)7-10(6-8)18(16,17)15-11-3-1-2-4-14-11/h1-7H,(H,14,15)
InChIKeyMUSPEAGQMIATJM-UHFFFAOYSA-N
MW270.26 g/mol
LogP2.16
Rot. Bonds3

About 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide

3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide (PubChem CID 142789105) has the molecular formula C11H8F2N2O2S and a molecular weight of 270.26 g/mol. Its IUPAC name is 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide
PubChem CID142789105
Molecular FormulaC11H8F2N2O2S
Molecular Weight270.26 g/mol
Exact Mass270.03
IUPAC Name3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide
SMILESO=S(=O)(Nc1ccccn1)c1cc(F)cc(F)c1
InChIInChI=1S/C11H8F2N2O2S/c12-8-5-9(13)7-10(6-8)18(16,17)15-11-3-1-2-4-14-11/h1-7H,(H,14,15)
InChIKeyMUSPEAGQMIATJM-UHFFFAOYSA-N
XLogP2.16
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide?
The IUPAC name of 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide (CID 142789105) is 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide.
What is the SMILES notation for 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide?
The canonical SMILES for 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide is O=S(=O)(Nc1ccccn1)c1cc(F)cc(F)c1.
What is the InChIKey of 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide?
The InChIKey is MUSPEAGQMIATJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F2N2O2S/c12-8-5-9(13)7-10(6-8)18(16,17)15-11-3-1-2-4-14-11/h1-7H,(H,14,15).
What are the key properties of 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide?
3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide has a molecular weight of 270.26 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-pyridin-2-ylbenzenesulfonamide is sourced from PubChem (CID 142789105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).