N,1,2-trimethylimidazole-4-sulfonamide

C6H11N3O2S — CID 23573311

IUPACN,1,2-trimethylimidazole-4-sulfonamide
SMILESCNS(=O)(=O)c1cn(C)c(C)n1
InChIInChI=1S/C6H11N3O2S/c1-5-8-6(4-9(5)3)12(10,11)7-2/h4,7H,1-3H3
InChIKeyDCERMBUPWVGAOI-UHFFFAOYSA-N
MW189.24 g/mol
LogP-0.36
Rot. Bonds2

About N,1,2-trimethylimidazole-4-sulfonamide

N,1,2-trimethylimidazole-4-sulfonamide (PubChem CID 23573311) has the molecular formula C6H11N3O2S and a molecular weight of 189.24 g/mol. Its IUPAC name is N,1,2-trimethylimidazole-4-sulfonamide.

Molecular Properties

Compound NameN,1,2-trimethylimidazole-4-sulfonamide
PubChem CID23573311
Molecular FormulaC6H11N3O2S
Molecular Weight189.24 g/mol
Exact Mass189.06
IUPAC NameN,1,2-trimethylimidazole-4-sulfonamide
SMILESCNS(=O)(=O)c1cn(C)c(C)n1
InChIInChI=1S/C6H11N3O2S/c1-5-8-6(4-9(5)3)12(10,11)7-2/h4,7H,1-3H3
InChIKeyDCERMBUPWVGAOI-UHFFFAOYSA-N
XLogP-0.36
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.24
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,2-dimethyl-N-[4-(methylamino)cyclohexyl]imidazole-4-sulfonamide
CID 62063852
N-(4-chloro-2-methylphenyl)-1,2-dimethylimidazole-4-sulfonamide
CID 53008171
1,2-dimethyl-N-(4-methylphenyl)imidazole-4-sulfonamide
CID 53008183
N-(1-bromo-3-methylbutan-2-yl)-1,2-dimethylimidazole-4-sulfonamide
CID 114294711
N-(4-hydroxy-2,5-dimethylphenyl)-1,2-dimethylimidazole-4-sulfonamide
CID 106831909
3-[(1,2-dimethylimidazol-4-yl)sulfonylamino]-2-hydroxypropanoic acid
CID 66167715
[(1,2-dimethylimidazol-4-yl)sulfonylamino]thiourea
CID 65214168
N-[(2S)-2-hydroxypropyl]-1,2-dimethylimidazole-4-sulfonamide
CID 83031032
2-[(1,2-dimethylimidazol-4-yl)sulfonylamino]-2-methylpropanoic acid
CID 55030383
N-(2-aminopentyl)-1,2-dimethylimidazole-4-sulfonamide
CID 115752601
N-(5-bromo-3-methyl-2-pyridinyl)-1,2-dimethylimidazole-4-sulfonamide
CID 81422954
(2R)-2-[(1,2-dimethylimidazol-4-yl)sulfonylamino]-3-methylbutanoic acid
CID 79011211

Frequently Asked Questions

What is the IUPAC name of N,1,2-trimethylimidazole-4-sulfonamide?
The IUPAC name of N,1,2-trimethylimidazole-4-sulfonamide (CID 23573311) is N,1,2-trimethylimidazole-4-sulfonamide.
What is the SMILES notation for N,1,2-trimethylimidazole-4-sulfonamide?
The canonical SMILES for N,1,2-trimethylimidazole-4-sulfonamide is CNS(=O)(=O)c1cn(C)c(C)n1.
What is the InChIKey of N,1,2-trimethylimidazole-4-sulfonamide?
The InChIKey is DCERMBUPWVGAOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O2S/c1-5-8-6(4-9(5)3)12(10,11)7-2/h4,7H,1-3H3.
What are the key properties of N,1,2-trimethylimidazole-4-sulfonamide?
N,1,2-trimethylimidazole-4-sulfonamide has a molecular weight of 189.24 g/mol, XLogP of -0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,2-trimethylimidazole-4-sulfonamide is sourced from PubChem (CID 23573311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).