4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide

C16H19NO4S — CID 7559506

IUPAC4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccccc2OCC)cc1
InChIInChI=1S/C16H19NO4S/c1-3-20-13-9-11-14(12-10-13)22(18,19)17-15-7-5-6-8-16(15)21-4-2/h5-12,17H,3-4H2,1-2H3
InChIKeyOIQDKEMVSVFJBP-UHFFFAOYSA-N
MW321.40 g/mol
LogP3.28
Rot. Bonds7

About 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide

4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide (PubChem CID 7559506) has the molecular formula C16H19NO4S and a molecular weight of 321.40 g/mol. Its IUPAC name is 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
PubChem CID7559506
Molecular FormulaC16H19NO4S
Molecular Weight321.40 g/mol
Exact Mass321.10
IUPAC Name4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccccc2OCC)cc1
InChIInChI=1S/C16H19NO4S/c1-3-20-13-9-11-14(12-10-13)22(18,19)17-15-7-5-6-8-16(15)21-4-2/h5-12,17H,3-4H2,1-2H3
InChIKeyOIQDKEMVSVFJBP-UHFFFAOYSA-N
XLogP3.28
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-ethoxyphenyl)sulfonylamino]-N-(2-methoxyphenyl)benzenesulfonamide
CID 22202817
ethyl 2-[4-[(2-ethoxyphenyl)sulfamoyl]phenoxy]acetate
CID 126143243
N-(2-ethoxyphenyl)-4-hydrazinylbenzenesulfonamide
CID 43454824
4-(aminomethyl)-N-(2-ethoxyphenyl)benzenesulfonamide
CID 28546723
N-[2-(4-ethoxyphenoxy)phenyl]-4-propan-2-ylbenzenesulfonamide
CID 7938368
N-(2-ethoxyphenyl)-4-nitrobenzenesulfonamide
CID 779776
4-(2-chloroethyl)-N-(2-ethoxyphenyl)benzenesulfonamide
CID 56690501
N-(2-ethoxyphenyl)-2-[4-[(4-ethoxyphenyl)sulfamoyl]phenoxy]acetamide
CID 126393709
4-ethoxy-N-(2-ethylsulfanylphenyl)benzenesulfonamide
CID 30396497
N-(2-ethoxyphenyl)-2-[4-[(2-methylphenyl)sulfamoyl]phenoxy]acetamide
CID 3968291
N-(2-butylphenyl)-4-ethoxybenzenesulfonamide
CID 22774366
N-(2,5-diethoxyphenyl)-4-iodobenzenesulfonamide
CID 3792893

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide?
The IUPAC name of 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide (CID 7559506) is 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide?
The canonical SMILES for 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide is CCOc1ccc(S(=O)(=O)Nc2ccccc2OCC)cc1.
What is the InChIKey of 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide?
The InChIKey is OIQDKEMVSVFJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO4S/c1-3-20-13-9-11-14(12-10-13)22(18,19)17-15-7-5-6-8-16(15)21-4-2/h5-12,17H,3-4H2,1-2H3.
What are the key properties of 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide?
4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide has a molecular weight of 321.40 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 7559506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).