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

C11H13N3O2S — CID 63000163

IUPAC2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
SMILESCc1cccc(NS(=O)(=O)c2cnc(C)[nH]2)c1
InChIInChI=1S/C11H13N3O2S/c1-8-4-3-5-10(6-8)14-17(15,16)11-7-12-9(2)13-11/h3-7,14H,1-2H3,(H,12,13)
InChIKeyRFJSKZPJLYPQNS-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.83
Rot. Bonds3

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

2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide (PubChem CID 63000163) has the molecular formula C11H13N3O2S and a molecular weight of 251.31 g/mol. Its IUPAC name is 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
PubChem CID63000163
Molecular FormulaC11H13N3O2S
Molecular Weight251.31 g/mol
Exact Mass251.07
IUPAC Name2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
SMILESCc1cccc(NS(=O)(=O)c2cnc(C)[nH]2)c1
InChIInChI=1S/C11H13N3O2S/c1-8-4-3-5-10(6-8)14-17(15,16)11-7-12-9(2)13-11/h3-7,14H,1-2H3,(H,12,13)
InChIKeyRFJSKZPJLYPQNS-UHFFFAOYSA-N
XLogP1.83
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dimethylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 62997984
3-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzoic acid
CID 62999270
2-methyl-N-[3-(trifluoromethyl)phenyl]-1H-imidazole-5-sulfonamide
CID 62998902
2-methyl-N-[4-(3-methylanilino)quinazolin-6-yl]-1H-imidazole-5-sulfonamide
CID 67622725
N-(2,6-dibromophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 104922595
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-(4-fluorophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 62998345
2-[3-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]phenoxy]acetamide
CID 63000197
N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
CID 3658049
N-(3-bromo-4-methoxyphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 63999221
2-methyl-N-(2,4,6-trimethylphenyl)-1H-imidazole-5-sulfonamide
CID 62999451

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide (CID 63000163) is 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide is Cc1cccc(NS(=O)(=O)c2cnc(C)[nH]2)c1.
What is the InChIKey of 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide?
The InChIKey is RFJSKZPJLYPQNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S/c1-8-4-3-5-10(6-8)14-17(15,16)11-7-12-9(2)13-11/h3-7,14H,1-2H3,(H,12,13).
What are the key properties of 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide?
2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide has a molecular weight of 251.31 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 63000163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).