4-ethyl-N-pyridin-2-ylbenzenesulfonamide

C13H14N2O2S — CID 961408

IUPAC4-ethyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C13H14N2O2S/c1-2-11-6-8-12(9-7-11)18(16,17)15-13-5-3-4-10-14-13/h3-10H,2H2,1H3,(H,14,15)
InChIKeyQFKCEHLRISHVQY-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.44
Rot. Bonds4

About 4-ethyl-N-pyridin-2-ylbenzenesulfonamide

4-ethyl-N-pyridin-2-ylbenzenesulfonamide (PubChem CID 961408) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 4-ethyl-N-pyridin-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-pyridin-2-ylbenzenesulfonamide
PubChem CID961408
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name4-ethyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C13H14N2O2S/c1-2-11-6-8-12(9-7-11)18(16,17)15-13-5-3-4-10-14-13/h3-10H,2H2,1H3,(H,14,15)
InChIKeyQFKCEHLRISHVQY-UHFFFAOYSA-N
XLogP2.44
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-pyridin-2-ylbenzenesulfonamide?
The IUPAC name of 4-ethyl-N-pyridin-2-ylbenzenesulfonamide (CID 961408) is 4-ethyl-N-pyridin-2-ylbenzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-pyridin-2-ylbenzenesulfonamide?
The canonical SMILES for 4-ethyl-N-pyridin-2-ylbenzenesulfonamide is CCc1ccc(S(=O)(=O)Nc2ccccn2)cc1.
What is the InChIKey of 4-ethyl-N-pyridin-2-ylbenzenesulfonamide?
The InChIKey is QFKCEHLRISHVQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-2-11-6-8-12(9-7-11)18(16,17)15-13-5-3-4-10-14-13/h3-10H,2H2,1H3,(H,14,15).
What are the key properties of 4-ethyl-N-pyridin-2-ylbenzenesulfonamide?
4-ethyl-N-pyridin-2-ylbenzenesulfonamide has a molecular weight of 262.33 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-pyridin-2-ylbenzenesulfonamide is sourced from PubChem (CID 961408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).