(4-fluoro-2-methylphenyl)methanesulfonamide

C8H10FNO2S — CID 62135164

IUPAC(4-fluoro-2-methylphenyl)methanesulfonamide
SMILESCc1cc(F)ccc1CS(N)(=O)=O
InChIInChI=1S/C8H10FNO2S/c1-6-4-8(9)3-2-7(6)5-13(10,11)12/h2-4H,5H2,1H3,(H2,10,11,12)
InChIKeyNSTXYAFVZNXQTB-UHFFFAOYSA-N
MW203.24 g/mol
LogP0.92
Rot. Bonds2

About (4-fluoro-2-methylphenyl)methanesulfonamide

(4-fluoro-2-methylphenyl)methanesulfonamide (PubChem CID 62135164) has the molecular formula C8H10FNO2S and a molecular weight of 203.24 g/mol. Its IUPAC name is (4-fluoro-2-methylphenyl)methanesulfonamide.

Molecular Properties

Compound Name(4-fluoro-2-methylphenyl)methanesulfonamide
PubChem CID62135164
Molecular FormulaC8H10FNO2S
Molecular Weight203.24 g/mol
Exact Mass203.04
IUPAC Name(4-fluoro-2-methylphenyl)methanesulfonamide
SMILESCc1cc(F)ccc1CS(N)(=O)=O
InChIInChI=1S/C8H10FNO2S/c1-6-4-8(9)3-2-7(6)5-13(10,11)12/h2-4H,5H2,1H3,(H2,10,11,12)
InChIKeyNSTXYAFVZNXQTB-UHFFFAOYSA-N
XLogP0.92
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Benzenemethanesulfonamide
CID 78318
4-Methylphenyl-difluoromethanesulfonamide
CID 44405177
N-Benzylsulfonylhydroxylamin
CID 23645541
Benzeneethanesulfonamide
CID 204808
3-Phenylpropane-1-sulfonamide
CID 12574638
N-methyl-1-phenylmethanesulfonamide
CID 290582
(1E)-2-Phenylethenesulfonamide
CID 5357731
Fluoro(phenyl)methanesulfonamide
CID 11355950
1-[4''-(Trifluoromethyl)-4-biphenylyl]methanesulfonamide
CID 23626137
3-Phenylpropane-1-sulfonyl fluoride
CID 25017076
4-Phenylbutane-1-sulfonyl fluoride
CID 71452049
(3-Fluoro-4-methylphenyl)methanesulfonamide
CID 63648807

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-methylphenyl)methanesulfonamide?
The IUPAC name of (4-fluoro-2-methylphenyl)methanesulfonamide (CID 62135164) is (4-fluoro-2-methylphenyl)methanesulfonamide.
What is the SMILES notation for (4-fluoro-2-methylphenyl)methanesulfonamide?
The canonical SMILES for (4-fluoro-2-methylphenyl)methanesulfonamide is Cc1cc(F)ccc1CS(N)(=O)=O.
What is the InChIKey of (4-fluoro-2-methylphenyl)methanesulfonamide?
The InChIKey is NSTXYAFVZNXQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2S/c1-6-4-8(9)3-2-7(6)5-13(10,11)12/h2-4H,5H2,1H3,(H2,10,11,12).
What are the key properties of (4-fluoro-2-methylphenyl)methanesulfonamide?
(4-fluoro-2-methylphenyl)methanesulfonamide has a molecular weight of 203.24 g/mol, XLogP of 0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-methylphenyl)methanesulfonamide is sourced from PubChem (CID 62135164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).