4-(4-propoxyphenoxy)benzenesulfonamide

C15H17NO4S — CID 43342703

IUPAC4-(4-propoxyphenoxy)benzenesulfonamide
SMILESCCCOc1ccc(Oc2ccc(S(N)(=O)=O)cc2)cc1
InChIInChI=1S/C15H17NO4S/c1-2-11-19-12-3-5-13(6-4-12)20-14-7-9-15(10-8-14)21(16,17)18/h3-10H,2,11H2,1H3,(H2,16,17,18)
InChIKeyHXFUEBMPVLRRHP-UHFFFAOYSA-N
MW307.37 g/mol
LogP2.92
Rot. Bonds6

About 4-(4-propoxyphenoxy)benzenesulfonamide

4-(4-propoxyphenoxy)benzenesulfonamide (PubChem CID 43342703) has the molecular formula C15H17NO4S and a molecular weight of 307.37 g/mol. Its IUPAC name is 4-(4-propoxyphenoxy)benzenesulfonamide.

Molecular Properties

Compound Name4-(4-propoxyphenoxy)benzenesulfonamide
PubChem CID43342703
Molecular FormulaC15H17NO4S
Molecular Weight307.37 g/mol
Exact Mass307.09
IUPAC Name4-(4-propoxyphenoxy)benzenesulfonamide
SMILESCCCOc1ccc(Oc2ccc(S(N)(=O)=O)cc2)cc1
InChIInChI=1S/C15H17NO4S/c1-2-11-19-12-3-5-13(6-4-12)20-14-7-9-15(10-8-14)21(16,17)18/h3-10H,2,11H2,1H3,(H2,16,17,18)
InChIKeyHXFUEBMPVLRRHP-UHFFFAOYSA-N
XLogP2.92
TPSA78.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-butoxyphenyl)diazenyl]benzenesulfonamide
CID 3089332
4-[2-(dimethylamino)ethoxy]benzenesulfonamide
CID 22244704
4-[4-(aminomethyl)phenoxy]benzenesulfonamide
CID 106485731
[4-(4-propoxyphenoxy)phenyl]methanamine
CID 28971093
4-[3-(2-propylphenoxy)propoxy]benzenesulfonamide
CID 69222529
azane;4-(4-pentoxyphenoxy)benzenesulfonic acid
CID 173280419
4-(4-iodophenoxy)benzenesulfonamide
CID 43164749
4-propoxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide
CID 4938795
4-(4-sulfamoylphenoxy)butanoic acid
CID 43164527
4-[2-[2-methoxyethyl(methyl)amino]ethoxy]benzenesulfonamide
CID 47294827
4-[2-[(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethoxy]benzenesulfonamide
CID 17418416
[(2R)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl] 4-propoxybenzoate
CID 7211739

Frequently Asked Questions

What is the IUPAC name of 4-(4-propoxyphenoxy)benzenesulfonamide?
The IUPAC name of 4-(4-propoxyphenoxy)benzenesulfonamide (CID 43342703) is 4-(4-propoxyphenoxy)benzenesulfonamide.
What is the SMILES notation for 4-(4-propoxyphenoxy)benzenesulfonamide?
The canonical SMILES for 4-(4-propoxyphenoxy)benzenesulfonamide is CCCOc1ccc(Oc2ccc(S(N)(=O)=O)cc2)cc1.
What is the InChIKey of 4-(4-propoxyphenoxy)benzenesulfonamide?
The InChIKey is HXFUEBMPVLRRHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4S/c1-2-11-19-12-3-5-13(6-4-12)20-14-7-9-15(10-8-14)21(16,17)18/h3-10H,2,11H2,1H3,(H2,16,17,18).
What are the key properties of 4-(4-propoxyphenoxy)benzenesulfonamide?
4-(4-propoxyphenoxy)benzenesulfonamide has a molecular weight of 307.37 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propoxyphenoxy)benzenesulfonamide is sourced from PubChem (CID 43342703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).