2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide

C16H18N2O4S — CID 19388075

IUPAC2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide
SMILESNC(=O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C16H18N2O4S/c17-16(19)12-22-14-8-6-13(7-9-14)10-11-18-23(20,21)15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H2,17,19)
InChIKeyOZFBCQPJVNSECU-UHFFFAOYSA-N
MW334.40 g/mol
LogP1.07
Rot. Bonds8

About 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide

2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide (PubChem CID 19388075) has the molecular formula C16H18N2O4S and a molecular weight of 334.40 g/mol. Its IUPAC name is 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide
PubChem CID19388075
Molecular FormulaC16H18N2O4S
Molecular Weight334.40 g/mol
Exact Mass334.10
IUPAC Name2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide
SMILESNC(=O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C16H18N2O4S/c17-16(19)12-22-14-8-6-13(7-9-14)10-11-18-23(20,21)15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H2,17,19)
InChIKeyOZFBCQPJVNSECU-UHFFFAOYSA-N
XLogP1.07
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide
CID 54332606
N,N-dibenzyl-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 126117629
N-[(1S)-1-phenylethyl]-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 1314125
2-phenoxy-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5187425
N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 126119881
2-[4-(benzenesulfonamidomethyl)phenoxy]acetic acid
CID 23470953
2-[2-(benzenesulfonamido)ethoxy]acetamide
CID 103766575
2-(4-bromophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5173418
N-(2,6-dichlorophenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 126122414
ethyl 3-[4-[2-(benzenesulfonamido)ethyl]phenyl]propanoate
CID 57249051
N-(2-cyanophenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 122189465
N-[1-(4-methylsulfanylphenyl)ethyl]-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 43873186

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide?
The IUPAC name of 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide (CID 19388075) is 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide.
What is the SMILES notation for 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide?
The canonical SMILES for 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide is NC(=O)COc1ccc(CCNS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide?
The InChIKey is OZFBCQPJVNSECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4S/c17-16(19)12-22-14-8-6-13(7-9-14)10-11-18-23(20,21)15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H2,17,19).
What are the key properties of 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide?
2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide has a molecular weight of 334.40 g/mol, XLogP of 1.07, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide is sourced from PubChem (CID 19388075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).