4-ethoxy-N-(4-methylphenyl)benzenesulfonamide

C15H17NO3S — CID 925010

IUPAC4-ethoxy-N-(4-methylphenyl)benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C15H17NO3S/c1-3-19-14-8-10-15(11-9-14)20(17,18)16-13-6-4-12(2)5-7-13/h4-11,16H,3H2,1-2H3
InChIKeyRBUUSVUWBYKFII-UHFFFAOYSA-N
MW291.37 g/mol
LogP3.19
Rot. Bonds5

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

4-ethoxy-N-(4-methylphenyl)benzenesulfonamide (PubChem CID 925010) has the molecular formula C15H17NO3S and a molecular weight of 291.37 g/mol. Its IUPAC name is 4-ethoxy-N-(4-methylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-(4-methylphenyl)benzenesulfonamide
PubChem CID925010
Molecular FormulaC15H17NO3S
Molecular Weight291.37 g/mol
Exact Mass291.09
IUPAC Name4-ethoxy-N-(4-methylphenyl)benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1
InChIInChI=1S/C15H17NO3S/c1-3-19-14-8-10-15(11-9-14)20(17,18)16-13-6-4-12(2)5-7-13/h4-11,16H,3H2,1-2H3
InChIKeyRBUUSVUWBYKFII-UHFFFAOYSA-N
XLogP3.19
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4202178
4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide
CID 848328
N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-4-(4-methylphenoxy)butanamide
CID 21173979
N-[4-(4-ethoxyanilino)phenyl]-4-methoxybenzenesulfonamide
CID 112987708
4-ethoxy-N-(4-methylsulfanylphenyl)benzenesulfonamide
CID 8860403
N-(4-ethoxyphenyl)-4-prop-2-enoxybenzenesulfonamide
CID 141457924
2-[4-[(4-ethoxyphenyl)sulfamoyl]phenoxy]-N-[(4-methylphenyl)methyl]acetamide
CID 3943831
ethyl N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamate
CID 17147479
N-(4-ethoxyphenyl)-2-[4-[(4-methylphenyl)sulfonylamino]phenyl]sulfanylacetamide
CID 23094970
2-[4-[(4-ethoxyphenyl)sulfonylamino]phenoxy]acetic acid
CID 1260151
N-(4-methylphenyl)-4-prop-2-ynoxybenzenesulfonamide
CID 141457876
N-[3-[(4-ethoxyphenoxy)methyl]phenyl]-4-methylbenzenesulfonamide
CID 169372191

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(4-methylphenyl)benzenesulfonamide?
The IUPAC name of 4-ethoxy-N-(4-methylphenyl)benzenesulfonamide (CID 925010) is 4-ethoxy-N-(4-methylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-ethoxy-N-(4-methylphenyl)benzenesulfonamide?
The canonical SMILES for 4-ethoxy-N-(4-methylphenyl)benzenesulfonamide is CCOc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1.
What is the InChIKey of 4-ethoxy-N-(4-methylphenyl)benzenesulfonamide?
The InChIKey is RBUUSVUWBYKFII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3S/c1-3-19-14-8-10-15(11-9-14)20(17,18)16-13-6-4-12(2)5-7-13/h4-11,16H,3H2,1-2H3.
What are the key properties of 4-ethoxy-N-(4-methylphenyl)benzenesulfonamide?
4-ethoxy-N-(4-methylphenyl)benzenesulfonamide has a molecular weight of 291.37 g/mol, XLogP of 3.19, 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-methylphenyl)benzenesulfonamide is sourced from PubChem (CID 925010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).