N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide

C13H13FN2O2S — CID 25042631

IUPACN-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide
SMILESCCc1cccc(NS(=O)(=O)c2ccccc2F)n1
InChIInChI=1S/C13H13FN2O2S/c1-2-10-6-5-9-13(15-10)16-19(17,18)12-8-4-3-7-11(12)14/h3-9H,2H2,1H3,(H,15,16)
InChIKeyRVLBWTFWXAOXAJ-UHFFFAOYSA-N
MW280.32 g/mol
LogP2.58
Rot. Bonds4

About N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide

N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide (PubChem CID 25042631) has the molecular formula C13H13FN2O2S and a molecular weight of 280.32 g/mol. Its IUPAC name is N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide.

Molecular Properties

Compound NameN-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide
PubChem CID25042631
Molecular FormulaC13H13FN2O2S
Molecular Weight280.32 g/mol
Exact Mass280.07
IUPAC NameN-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide
SMILESCCc1cccc(NS(=O)(=O)c2ccccc2F)n1
InChIInChI=1S/C13H13FN2O2S/c1-2-10-6-5-9-13(15-10)16-19(17,18)12-8-4-3-7-11(12)14/h3-9H,2H2,1H3,(H,15,16)
InChIKeyRVLBWTFWXAOXAJ-UHFFFAOYSA-N
XLogP2.58
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[(6-ethyl-2-pyridinyl)sulfamoyl]benzoate
CID 3376237
2,5-dichloro-N-(6-ethyl-2-pyridinyl)benzenesulfonamide
CID 3868272
4-ethyl-N-(6-ethyl-2-pyridinyl)benzenesulfonamide
CID 3256237
N-(5-bromo-6-methyl-2-pyridinyl)-2-fluorobenzenesulfonamide
CID 25035957
CID 163768637
CID 163768637
3-chloro-2-methyl-N-(6-propyl-2-pyridinyl)benzenesulfonamide
CID 11702579
N-(5-tert-butyl-1,2,4-oxadiazol-3-yl)-2-fluorobenzenesulfonamide
CID 84599824
2-fluoro-N-pyrazin-2-ylbenzenesulfonamide
CID 43616158
N-(4-bromo-2-ethylphenyl)-2-fluorobenzenesulfonamide
CID 80974925
2-fluoro-N-(2,4,6-triiodophenyl)benzenesulfonamide
CID 63495225
N-[6-(aminomethyl)-2-pyridinyl]-4-fluorobenzenesulfonamide
CID 82343421
N-(4-chloropyrimidin-2-yl)-2-fluorobenzenesulfonamide
CID 114052249

Frequently Asked Questions

What is the IUPAC name of N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide?
The IUPAC name of N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide (CID 25042631) is N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide.
What is the SMILES notation for N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide?
The canonical SMILES for N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide is CCc1cccc(NS(=O)(=O)c2ccccc2F)n1.
What is the InChIKey of N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide?
The InChIKey is RVLBWTFWXAOXAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O2S/c1-2-10-6-5-9-13(15-10)16-19(17,18)12-8-4-3-7-11(12)14/h3-9H,2H2,1H3,(H,15,16).
What are the key properties of N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide?
N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide has a molecular weight of 280.32 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-ethyl-2-pyridinyl)-2-fluorobenzenesulfonamide is sourced from PubChem (CID 25042631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).