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

C16H18N2O3S — CID 54332606

IUPAC2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide
SMILESNC(=O)Cc1ccc(CCNS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C16H18N2O3S/c17-16(19)12-14-8-6-13(7-9-14)10-11-18-22(20,21)15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H2,17,19)
InChIKeySZJZIMSQKBQKKW-UHFFFAOYSA-N
MW318.40 g/mol
LogP1.24
Rot. Bonds7

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

2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide (PubChem CID 54332606) has the molecular formula C16H18N2O3S and a molecular weight of 318.40 g/mol. Its IUPAC name is 2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide
PubChem CID54332606
Molecular FormulaC16H18N2O3S
Molecular Weight318.40 g/mol
Exact Mass318.10
IUPAC Name2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide
SMILESNC(=O)Cc1ccc(CCNS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C16H18N2O3S/c17-16(19)12-14-8-6-13(7-9-14)10-11-18-22(20,21)15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H2,17,19)
InChIKeySZJZIMSQKBQKKW-UHFFFAOYSA-N
XLogP1.24
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide
CID 19388075
ethyl 3-[4-[2-(benzenesulfonamido)ethyl]phenyl]propanoate
CID 57249051
N-[2-(3,4-dihydroxyphenyl)ethyl]benzenesulfonamide
CID 90129375
2-[4-[2-[(4-acetylphenyl)sulfonylamino]ethyl]phenyl]acetic acid
CID 12945846
3-(benzenesulfonamido)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
CID 27538225
4-(benzenesulfonamido)-N-(2-phenylethyl)benzenesulfonamide
CID 5222462
4-hydrazinyl-N-(2-phenylethyl)benzenesulfonamide
CID 43454992
3-(hydrazinecarbonyl)-N-(2-phenylethyl)benzenesulfonamide
CID 100656698
2-[4-[2-(benzenesulfonamido)ethyl]phenyl]-4-oxobutanoic acid
CID 88613840
2-[2-(benzenesulfonamido)ethoxy]acetamide
CID 103766575
2-[4-[2-(carbamoylamino)ethylsulfamoyl]phenyl]acetic acid
CID 83116835
N-[2-[4-(3-fluorobenzoyl)phenyl]ethyl]benzenesulfonamide
CID 174893416

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide?
The IUPAC name of 2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide (CID 54332606) is 2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide.
What is the SMILES notation for 2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide?
The canonical SMILES for 2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide is NC(=O)Cc1ccc(CCNS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide?
The InChIKey is SZJZIMSQKBQKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3S/c17-16(19)12-14-8-6-13(7-9-14)10-11-18-22(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]phenyl]acetamide?
2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide has a molecular weight of 318.40 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(benzenesulfonamido)ethyl]phenyl]acetamide is sourced from PubChem (CID 54332606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).