N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide

C13H20N2O4S — CID 113355675

IUPACN-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide
SMILESCc1cc(S(N)(=O)=O)cc(C)c1NC(=O)COC(C)C
InChIInChI=1S/C13H20N2O4S/c1-8(2)19-7-12(16)15-13-9(3)5-11(6-10(13)4)20(14,17)18/h5-6,8H,7H2,1-4H3,(H,15,16)(H2,14,17,18)
InChIKeyFOEUUZNFAUWTFG-UHFFFAOYSA-N
MW300.38 g/mol
LogP1.31
Rot. Bonds5

About N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide

N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide (PubChem CID 113355675) has the molecular formula C13H20N2O4S and a molecular weight of 300.38 g/mol. Its IUPAC name is N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide
PubChem CID113355675
Molecular FormulaC13H20N2O4S
Molecular Weight300.38 g/mol
Exact Mass300.11
IUPAC NameN-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide
SMILESCc1cc(S(N)(=O)=O)cc(C)c1NC(=O)COC(C)C
InChIInChI=1S/C13H20N2O4S/c1-8(2)19-7-12(16)15-13-9(3)5-11(6-10(13)4)20(14,17)18/h5-6,8H,7H2,1-4H3,(H,15,16)(H2,14,17,18)
InChIKeyFOEUUZNFAUWTFG-UHFFFAOYSA-N
XLogP1.31
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-5-methyl-4-[(2-propan-2-yloxyacetyl)amino]benzenesulfonyl chloride
CID 115949334
N-(2,6-dimethyl-4-sulfamoylphenyl)-2-ethylbutanamide
CID 43246820
N-(6-amino-2,3-dimethylphenyl)-2-propan-2-yloxyacetamide
CID 112601814
N-(2-amino-4,5-dimethylphenyl)-2-propan-2-yloxyacetamide
CID 112601871
2-propan-2-yloxy-N-(2,4,6-trichlorophenyl)acetamide
CID 112604411
N-[2-methyl-5-(methylsulfamoyl)phenyl]-2-propan-2-yloxyacetamide
CID 47413216
4-[(2-ethoxyacetyl)amino]-3,5-dimethylbenzenesulfonyl chloride
CID 43097969
2-propan-2-yloxyethyl 2,3-dimethyl-5-sulfamoylbenzoate
CID 65382072
N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(propan-2-ylamino)acetamide
CID 60671270
3,5-dimethyl-4-(propan-2-ylsulfonylamino)benzenesulfonamide
CID 60864212
2-bromo-4-[(2-propan-2-yloxyacetyl)amino]benzenesulfonyl chloride
CID 112602478
2-ethyl-N-(2-ethyl-6-methyl-4-sulfamoylphenyl)butanamide
CID 43133984

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide?
The IUPAC name of N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide (CID 113355675) is N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide?
The canonical SMILES for N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide is Cc1cc(S(N)(=O)=O)cc(C)c1NC(=O)COC(C)C.
What is the InChIKey of N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide?
The InChIKey is FOEUUZNFAUWTFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4S/c1-8(2)19-7-12(16)15-13-9(3)5-11(6-10(13)4)20(14,17)18/h5-6,8H,7H2,1-4H3,(H,15,16)(H2,14,17,18).
What are the key properties of N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide?
N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide has a molecular weight of 300.38 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethyl-4-sulfamoylphenyl)-2-propan-2-yloxyacetamide is sourced from PubChem (CID 113355675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).