N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide

C13H20N2O3S — CID 65375039

IUPACN-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide
SMILESCCN(C)C(=O)c1c(C)cc(C)c(S(N)(=O)=O)c1C
InChIInChI=1S/C13H20N2O3S/c1-6-15(5)13(16)11-8(2)7-9(3)12(10(11)4)19(14,17)18/h7H,6H2,1-5H3,(H2,14,17,18)
InChIKeyOHAZYSNROPTQKT-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.35
Rot. Bonds3

About N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide

N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide (PubChem CID 65375039) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide.

Molecular Properties

Compound NameN-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide
PubChem CID65375039
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC NameN-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide
SMILESCCN(C)C(=O)c1c(C)cc(C)c(S(N)(=O)=O)c1C
InChIInChI=1S/C13H20N2O3S/c1-6-15(5)13(16)11-8(2)7-9(3)12(10(11)4)19(14,17)18/h7H,6H2,1-5H3,(H2,14,17,18)
InChIKeyOHAZYSNROPTQKT-UHFFFAOYSA-N
XLogP1.35
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2,4,6-tetramethyl-N-(2-methylpropyl)-3-sulfamoylbenzamide
CID 65388716
ethyl 2,4,6-trimethyl-3-sulfamoylbenzoate
CID 63839844
2,4,6-trimethyl-N-(2-methylbutan-2-yl)-3-sulfamoylbenzamide
CID 65373603
N-cyclopropyl-2,4,6-trimethyl-3-sulfamoylbenzamide
CID 65373441
N-(1-methoxypropan-2-yl)-2,4,6-trimethyl-3-sulfamoylbenzamide
CID 65374186
oxetan-3-yl 2,4,6-trimethyl-3-sulfamoylbenzoate
CID 102608695
2,3,5,6-tetramethylbenzenesulfonamide
CID 5028412
3-[cyclopropyl(methyl)carbamoyl]-2,4,6-trimethylbenzenesulfonyl chloride
CID 65371645
2-bromo-N-ethyl-N,6-dimethylbenzamide
CID 130664662
N-ethyl-3-fluoro-N-methyl-5-sulfamoylbenzamide
CID 65375225
N-ethyl-2,4-difluoro-N-methyl-5-sulfamoylbenzamide
CID 65375226
N-ethyl-N,2,4-trimethylfuran-3-carboxamide
CID 131084548

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide?
The IUPAC name of N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide (CID 65375039) is N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide.
What is the SMILES notation for N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide?
The canonical SMILES for N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide is CCN(C)C(=O)c1c(C)cc(C)c(S(N)(=O)=O)c1C.
What is the InChIKey of N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide?
The InChIKey is OHAZYSNROPTQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-6-15(5)13(16)11-8(2)7-9(3)12(10(11)4)19(14,17)18/h7H,6H2,1-5H3,(H2,14,17,18).
What are the key properties of N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide?
N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide has a molecular weight of 284.38 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2,4,6-tetramethyl-3-sulfamoylbenzamide is sourced from PubChem (CID 65375039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).