N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide

C8H11FN2O2S — CID 122482905

IUPACN-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1cc(C)ncc1F
InChIInChI=1S/C8H11FN2O2S/c1-3-14(12,13)11-8-4-6(2)10-5-7(8)9/h4-5H,3H2,1-2H3,(H,10,11)
InChIKeyPEUNBUACTLSCCO-UHFFFAOYSA-N
MW218.25 g/mol
LogP1.29
Rot. Bonds3

About N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide

N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide (PubChem CID 122482905) has the molecular formula C8H11FN2O2S and a molecular weight of 218.25 g/mol. Its IUPAC name is N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide
PubChem CID122482905
Molecular FormulaC8H11FN2O2S
Molecular Weight218.25 g/mol
Exact Mass218.05
IUPAC NameN-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1cc(C)ncc1F
InChIInChI=1S/C8H11FN2O2S/c1-3-14(12,13)11-8-4-6(2)10-5-7(8)9/h4-5H,3H2,1-2H3,(H,10,11)
InChIKeyPEUNBUACTLSCCO-UHFFFAOYSA-N
XLogP1.29
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-fluoro-4-iodo-2-pyridinyl)ethanesulfonamide
CID 155434794
N-(6-chloro-4-methyl-3-pyridinyl)ethanesulfonamide
CID 130168364
N-[2-fluoro-5-(trifluoromethyl)phenyl]ethanesulfonamide
CID 22773510
N-(2,5-dimethyl-4-pyridinyl)methanesulfonamide
CID 126987931
N-(2-fluoro-5-methylphenyl)propane-1-sulfonamide
CID 60641408
N-(2,3-difluorophenyl)ethanesulfonamide
CID 64586893
N-[5-[[[2-anilino-5-(trifluoromethyl)pyrimidin-4-yl]amino]methyl]-2-methyl-4-pyridinyl]ethanesulfonamide
CID 91418047
N-(2,5-difluoro-4-methylphenyl)-2-ethyl-1H-imidazole-5-sulfonamide
CID 103586974
2-(methylamino)-N-(2,4,5-trifluorophenyl)ethanesulfonamide
CID 62809009
N-(3-bromo-4-fluorophenyl)ethanesulfonamide
CID 104779628
N-(2-chloro-5-fluorophenyl)ethanesulfonamide
CID 107531524
N-(2,5-dimethylphenyl)ethanesulfonamide
CID 902936

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide?
The IUPAC name of N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide (CID 122482905) is N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide.
What is the SMILES notation for N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide?
The canonical SMILES for N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide is CCS(=O)(=O)Nc1cc(C)ncc1F.
What is the InChIKey of N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide?
The InChIKey is PEUNBUACTLSCCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O2S/c1-3-14(12,13)11-8-4-6(2)10-5-7(8)9/h4-5H,3H2,1-2H3,(H,10,11).
What are the key properties of N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide?
N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide has a molecular weight of 218.25 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methyl-4-pyridinyl)ethanesulfonamide is sourced from PubChem (CID 122482905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).