N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide

C12H15N3O2S — CID 62997984

IUPACN-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1cc(C)cc(NS(=O)(=O)c2cnc(C)[nH]2)c1
InChIInChI=1S/C12H15N3O2S/c1-8-4-9(2)6-11(5-8)15-18(16,17)12-7-13-10(3)14-12/h4-7,15H,1-3H3,(H,13,14)
InChIKeyBXOZBESQLOZDQM-UHFFFAOYSA-N
MW265.34 g/mol
LogP2.14
Rot. Bonds3

About N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide

N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide (PubChem CID 62997984) has the molecular formula C12H15N3O2S and a molecular weight of 265.34 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
PubChem CID62997984
Molecular FormulaC12H15N3O2S
Molecular Weight265.34 g/mol
Exact Mass265.09
IUPAC NameN-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1cc(C)cc(NS(=O)(=O)c2cnc(C)[nH]2)c1
InChIInChI=1S/C12H15N3O2S/c1-8-4-9(2)6-11(5-8)15-18(16,17)12-7-13-10(3)14-12/h4-7,15H,1-3H3,(H,13,14)
InChIKeyBXOZBESQLOZDQM-UHFFFAOYSA-N
XLogP2.14
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
CID 63000163
2-methyl-N-(2,4,6-trimethylphenyl)-1H-imidazole-5-sulfonamide
CID 62999451
N-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 62998345
2-methyl-N-quinoxalin-6-yl-1H-imidazole-5-sulfonamide
CID 63000218
N-(3-hydroxy-4-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 64794398
N-(3-bromo-4-methoxyphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 63999221
N-(2,6-dibromophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 104922595
N-(5-bromo-3-methyl-2-pyridinyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 81422363
3,5-dimethyl-2-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzoic acid
CID 63000406
N-(3-chloro-4-hydroxyphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 64786558
2-methyl-N-[3-(trifluoromethyl)phenyl]-1H-imidazole-5-sulfonamide
CID 62998902
3-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzoic acid
CID 62999270

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide (CID 62997984) is N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide is Cc1cc(C)cc(NS(=O)(=O)c2cnc(C)[nH]2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The InChIKey is BXOZBESQLOZDQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2S/c1-8-4-9(2)6-11(5-8)15-18(16,17)12-7-13-10(3)14-12/h4-7,15H,1-3H3,(H,13,14).
What are the key properties of N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide?
N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide has a molecular weight of 265.34 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 62997984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).