4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide

C15H16FNO2S — CID 7516558

IUPAC4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2cc(C)ccc2F)cc1
InChIInChI=1S/C15H16FNO2S/c1-3-12-5-7-13(8-6-12)20(18,19)17-15-10-11(2)4-9-14(15)16/h4-10,17H,3H2,1-2H3
InChIKeyGXAPRCVTNWTQBD-UHFFFAOYSA-N
MW293.36 g/mol
LogP3.50
Rot. Bonds4

About 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide

4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide (PubChem CID 7516558) has the molecular formula C15H16FNO2S and a molecular weight of 293.36 g/mol. Its IUPAC name is 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
PubChem CID7516558
Molecular FormulaC15H16FNO2S
Molecular Weight293.36 g/mol
Exact Mass293.09
IUPAC Name4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2cc(C)ccc2F)cc1
InChIInChI=1S/C15H16FNO2S/c1-3-12-5-7-13(8-6-12)20(18,19)17-15-10-11(2)4-9-14(15)16/h4-10,17H,3H2,1-2H3
InChIKeyGXAPRCVTNWTQBD-UHFFFAOYSA-N
XLogP3.50
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-amino-2-fluorophenyl)-4-ethylbenzenesulfonamide
CID 43604941
4-amino-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
CID 28968050
4-[(2S)-butan-2-yl]-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
CID 8523559
N-[2-(difluoromethoxy)-5-methylphenyl]-4-ethylbenzenesulfonamide
CID 19684057
4-ethyl-N-(7-methylnaphthalen-1-yl)benzenesulfonamide
CID 121419270
2-[(4-ethylphenyl)sulfonylamino]-5-methylbenzoic acid
CID 51114828
4-(bromomethyl)-N-(2-fluoro-4-methylphenyl)benzenesulfonamide
CID 65480207
2-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide
CID 62143379
[4-fluoro-3-[(4-methylphenyl)sulfonylamino]phenyl]-methyl-oxoazanium
CID 159028628
N-(2-fluoro-5-methylphenyl)propane-1-sulfonamide
CID 60641408
3-amino-4-bromo-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
CID 115328714
2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide
CID 62143731

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide?
The IUPAC name of 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide (CID 7516558) is 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide?
The canonical SMILES for 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide is CCc1ccc(S(=O)(=O)Nc2cc(C)ccc2F)cc1.
What is the InChIKey of 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide?
The InChIKey is GXAPRCVTNWTQBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2S/c1-3-12-5-7-13(8-6-12)20(18,19)17-15-10-11(2)4-9-14(15)16/h4-10,17H,3H2,1-2H3.
What are the key properties of 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide?
4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide has a molecular weight of 293.36 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide is sourced from PubChem (CID 7516558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).