2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide

C12H18N2O4S — CID 82915001

IUPAC2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide
SMILESCC(C)(C)c1cc(S(N)(=O)=O)ccc1OCC(N)=O
InChIInChI=1S/C12H18N2O4S/c1-12(2,3)9-6-8(19(14,16)17)4-5-10(9)18-7-11(13)15/h4-6H,7H2,1-3H3,(H2,13,15)(H2,14,16,17)
InChIKeyQSTOVVPIGOGEJU-UHFFFAOYSA-N
MW286.35 g/mol
LogP0.50
Rot. Bonds4

About 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide

2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide (PubChem CID 82915001) has the molecular formula C12H18N2O4S and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide.

Molecular Properties

Compound Name2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide
PubChem CID82915001
Molecular FormulaC12H18N2O4S
Molecular Weight286.35 g/mol
Exact Mass286.10
IUPAC Name2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide
SMILESCC(C)(C)c1cc(S(N)(=O)=O)ccc1OCC(N)=O
InChIInChI=1S/C12H18N2O4S/c1-12(2,3)9-6-8(19(14,16)17)4-5-10(9)18-7-11(13)15/h4-6H,7H2,1-3H3,(H2,13,15)(H2,14,16,17)
InChIKeyQSTOVVPIGOGEJU-UHFFFAOYSA-N
XLogP0.50
TPSA112.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-tert-butylphenoxy)acetamide
CID 17051379
4-but-3-enoxy-3-tert-butylbenzenesulfonamide
CID 82915270
3-tert-butyl-4-pentan-2-yloxybenzenesulfonamide
CID 114013779
3-tert-butyl-4-(1,2,4-oxadiazol-3-ylmethoxy)benzenesulfonamide
CID 82913600
2-(4-tert-butyl-2-formylphenoxy)acetamide
CID 175660582
2-(2-bromo-4-sulfamoylphenoxy)acetic acid
CID 43164345
N-carbamoyl-2-(2-fluoro-4-sulfamoylphenoxy)acetamide
CID 82920985
2-(2,4-ditert-butylphenoxy)acetic acid
CID 794760
2-(2,6-dimethyl-4-sulfamoylphenoxy)acetamide
CID 82911999
2-[2-methoxy-5-[[(4-sulfamoylphenyl)hydrazinylidene]methyl]phenoxy]acetamide
CID 4840746
3-(aminomethyl)-4-(2,2,2-trifluoroethoxy)benzenesulfonamide
CID 67169343
(2,4-ditert-butylphenoxy)methyl hydrogen carbonate
CID 145055436

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide?
The IUPAC name of 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide (CID 82915001) is 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide.
What is the SMILES notation for 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide?
The canonical SMILES for 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide is CC(C)(C)c1cc(S(N)(=O)=O)ccc1OCC(N)=O.
What is the InChIKey of 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide?
The InChIKey is QSTOVVPIGOGEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O4S/c1-12(2,3)9-6-8(19(14,16)17)4-5-10(9)18-7-11(13)15/h4-6H,7H2,1-3H3,(H2,13,15)(H2,14,16,17).
What are the key properties of 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide?
2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide has a molecular weight of 286.35 g/mol, XLogP of 0.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-4-sulfamoylphenoxy)acetamide is sourced from PubChem (CID 82915001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).