N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide

C11H21N3O3S — CID 79387609

IUPACN-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide
SMILESCCN(CC(C)(C)O)S(=O)(=O)c1cn(C)c(C)n1
InChIInChI=1S/C11H21N3O3S/c1-6-14(8-11(3,4)15)18(16,17)10-7-13(5)9(2)12-10/h7,15H,6,8H2,1-5H3
InChIKeyNGKMANLMZQIMCC-UHFFFAOYSA-N
MW275.37 g/mol
LogP0.51
Rot. Bonds5

About N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide

N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide (PubChem CID 79387609) has the molecular formula C11H21N3O3S and a molecular weight of 275.37 g/mol. Its IUPAC name is N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide
PubChem CID79387609
Molecular FormulaC11H21N3O3S
Molecular Weight275.37 g/mol
Exact Mass275.13
IUPAC NameN-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide
SMILESCCN(CC(C)(C)O)S(=O)(=O)c1cn(C)c(C)n1
InChIInChI=1S/C11H21N3O3S/c1-6-14(8-11(3,4)15)18(16,17)10-7-13(5)9(2)12-10/h7,15H,6,8H2,1-5H3
InChIKeyNGKMANLMZQIMCC-UHFFFAOYSA-N
XLogP0.51
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide?
The IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide (CID 79387609) is N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide.
What is the SMILES notation for N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide?
The canonical SMILES for N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide is CCN(CC(C)(C)O)S(=O)(=O)c1cn(C)c(C)n1.
What is the InChIKey of N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide?
The InChIKey is NGKMANLMZQIMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3S/c1-6-14(8-11(3,4)15)18(16,17)10-7-13(5)9(2)12-10/h7,15H,6,8H2,1-5H3.
What are the key properties of N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide?
N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide has a molecular weight of 275.37 g/mol, XLogP of 0.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-hydroxy-2-methylpropyl)-1,2-dimethylimidazole-4-sulfonamide is sourced from PubChem (CID 79387609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).