4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide

C15H18N2O2S — CID 3256237

IUPAC4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2cccc(CC)n2)cc1
InChIInChI=1S/C15H18N2O2S/c1-3-12-8-10-14(11-9-12)20(18,19)17-15-7-5-6-13(4-2)16-15/h5-11H,3-4H2,1-2H3,(H,16,17)
InChIKeyJXKNFVGMCKROIB-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.01
Rot. Bonds5

About 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide

4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide (PubChem CID 3256237) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide
PubChem CID3256237
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2cccc(CC)n2)cc1
InChIInChI=1S/C15H18N2O2S/c1-3-12-8-10-14(11-9-12)20(18,19)17-15-7-5-6-13(4-2)16-15/h5-11H,3-4H2,1-2H3,(H,16,17)
InChIKeyJXKNFVGMCKROIB-UHFFFAOYSA-N
XLogP3.01
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 163768637
CID 163768637
N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide
CID 25042631
N-[6-(aminomethyl)-2-pyridinyl]-4-fluorobenzenesulfonamide
CID 82343421
methyl 2-[(6-ethyl-2-pyridinyl)sulfamoyl]benzoate
CID 3376237
4-ethyl-N-[4-[(2-methylpyrimidin-4-yl)sulfamoyl]phenyl]benzenesulfonamide
CID 19683655
2,5-dichloro-N-(6-ethyl-2-pyridinyl)benzenesulfonamide
CID 3868272
4-ethyl-N-[6-(propan-2-ylamino)pyridazin-3-yl]benzenesulfonamide
CID 113037996
4-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]benzenesulfonamide
CID 22206833
N-[6-(3-chloroanilino)pyridazin-3-yl]-4-ethylbenzenesulfonamide
CID 113047503
4-ethyl-N-[5-(propan-2-ylamino)-2-pyridinyl]benzenesulfonamide
CID 113023639
4-ethyl-N-(4-methylpyrimidin-2-yl)benzenesulfonamide
CID 17377245
4-ethyl-N-[4-(pyridin-2-ylmethylamino)phenyl]benzenesulfonamide
CID 112982965

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide (CID 3256237) is 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide is CCc1ccc(S(=O)(=O)Nc2cccc(CC)n2)cc1.
What is the InChIKey of 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide?
The InChIKey is JXKNFVGMCKROIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-3-12-8-10-14(11-9-12)20(18,19)17-15-7-5-6-13(4-2)16-15/h5-11H,3-4H2,1-2H3,(H,16,17).
What are the key properties of 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide?
4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide has a molecular weight of 290.39 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 3256237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).