4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide

C14H14FNO3S — CID 848328

IUPAC4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1
InChIInChI=1S/C14H14FNO3S/c1-2-19-13-7-9-14(10-8-13)20(17,18)16-12-5-3-11(15)4-6-12/h3-10,16H,2H2,1H3
InChIKeyYDUHEKFYGCJPTI-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.03
Rot. Bonds5

About 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide

4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide (PubChem CID 848328) has the molecular formula C14H14FNO3S and a molecular weight of 295.34 g/mol. Its IUPAC name is 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide
PubChem CID848328
Molecular FormulaC14H14FNO3S
Molecular Weight295.34 g/mol
Exact Mass295.07
IUPAC Name4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1
InChIInChI=1S/C14H14FNO3S/c1-2-19-13-7-9-14(10-8-13)20(17,18)16-12-5-3-11(15)4-6-12/h3-10,16H,2H2,1H3
InChIKeyYDUHEKFYGCJPTI-UHFFFAOYSA-N
XLogP3.03
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(4-ethoxyphenyl)sulfamoyl]phenoxy]-N-(4-fluorophenyl)acetamide
CID 126395320
N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-2,4-difluorobenzenesulfonamide
CID 2488296
4-ethoxy-N-(4-methylphenyl)benzenesulfonamide
CID 925010
4-ethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4202178
4-ethoxy-N-(4-methylsulfanylphenyl)benzenesulfonamide
CID 8860403
N-(4-ethoxyphenyl)-4-prop-2-enoxybenzenesulfonamide
CID 141457924
N-[4-(4-ethoxyanilino)phenyl]-4-methoxybenzenesulfonamide
CID 112987708
4-ethoxy-N-(3-fluoro-4-methylphenyl)benzenesulfonamide
CID 2121784
N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-2-[(4-fluorophenyl)methylsulfanyl]acetamide
CID 92677412
2-[4-[(4-ethoxyphenyl)sulfonylamino]phenoxy]acetic acid
CID 1260151
3-chloro-N-(4-ethoxyphenyl)-4-fluorobenzenesulfonamide
CID 889995
N-[3-(4-ethoxyanilino)quinoxalin-2-yl]-4-fluorobenzenesulfonamide
CID 1398916

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide?
The IUPAC name of 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide (CID 848328) is 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide.
What is the SMILES notation for 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide?
The canonical SMILES for 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide is CCOc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1.
What is the InChIKey of 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide?
The InChIKey is YDUHEKFYGCJPTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO3S/c1-2-19-13-7-9-14(10-8-13)20(17,18)16-12-5-3-11(15)4-6-12/h3-10,16H,2H2,1H3.
What are the key properties of 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide?
4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide has a molecular weight of 295.34 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide is sourced from PubChem (CID 848328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).