2-[(4-tert-butylphenyl)sulfonylamino]acetamide

C12H18N2O3S — CID 9189386

IUPAC2-[(4-tert-butylphenyl)sulfonylamino]acetamide
SMILESCC(C)(C)c1ccc(S(=O)(=O)NCC(N)=O)cc1
InChIInChI=1S/C12H18N2O3S/c1-12(2,3)9-4-6-10(7-5-9)18(16,17)14-8-11(13)15/h4-7,14H,8H2,1-3H3,(H2,13,15)
InChIKeyGIUUALYKNIYZNL-UHFFFAOYSA-N
MW270.35 g/mol
LogP0.75
Rot. Bonds4

About 2-[(4-tert-butylphenyl)sulfonylamino]acetamide

2-[(4-tert-butylphenyl)sulfonylamino]acetamide (PubChem CID 9189386) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-[(4-tert-butylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound Name2-[(4-tert-butylphenyl)sulfonylamino]acetamide
PubChem CID9189386
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name2-[(4-tert-butylphenyl)sulfonylamino]acetamide
SMILESCC(C)(C)c1ccc(S(=O)(=O)NCC(N)=O)cc1
InChIInChI=1S/C12H18N2O3S/c1-12(2,3)9-4-6-10(7-5-9)18(16,17)14-8-11(13)15/h4-7,14H,8H2,1-3H3,(H2,13,15)
InChIKeyGIUUALYKNIYZNL-UHFFFAOYSA-N
XLogP0.75
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-aminophenyl)sulfonylamino]acetamide
CID 3678127
2-[(4-hydrazinylphenyl)sulfonylamino]acetamide
CID 43545768
4-tert-butyl-N-ethylbenzenesulfonamide
CID 846956
N-butan-2-yl-2-[(4-tert-butylphenyl)sulfonylamino]acetamide
CID 112990855
2-[(4-cyanophenyl)sulfonylamino]acetamide
CID 4844985
N-butyl-2-[(4-tert-butylphenyl)sulfonylamino]acetamide
CID 112990709
2-[[4-(2-chloroethyl)phenyl]sulfonylamino]acetamide
CID 43662654
4-tert-butyl-N-(3-hydroxy-2,2-dimethylpropyl)benzenesulfonamide
CID 115362965
N-(2-aminopropyl)-4-tert-butylbenzenesulfonamide
CID 63733559
2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide
CID 43257083
4-tert-butyl-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzenesulfonamide
CID 112991053
N-(4-tert-butylphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetamide
CID 9203847

Frequently Asked Questions

What is the IUPAC name of 2-[(4-tert-butylphenyl)sulfonylamino]acetamide?
The IUPAC name of 2-[(4-tert-butylphenyl)sulfonylamino]acetamide (CID 9189386) is 2-[(4-tert-butylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for 2-[(4-tert-butylphenyl)sulfonylamino]acetamide?
The canonical SMILES for 2-[(4-tert-butylphenyl)sulfonylamino]acetamide is CC(C)(C)c1ccc(S(=O)(=O)NCC(N)=O)cc1.
What is the InChIKey of 2-[(4-tert-butylphenyl)sulfonylamino]acetamide?
The InChIKey is GIUUALYKNIYZNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-12(2,3)9-4-6-10(7-5-9)18(16,17)14-8-11(13)15/h4-7,14H,8H2,1-3H3,(H2,13,15).
What are the key properties of 2-[(4-tert-butylphenyl)sulfonylamino]acetamide?
2-[(4-tert-butylphenyl)sulfonylamino]acetamide has a molecular weight of 270.35 g/mol, XLogP of 0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-tert-butylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 9189386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).