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

C11H12ClN3O2S — CID 62997807

IUPACN-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2C)[nH]1
InChIInChI=1S/C11H12ClN3O2S/c1-7-3-4-9(12)5-10(7)15-18(16,17)11-6-13-8(2)14-11/h3-6,15H,1-2H3,(H,13,14)
InChIKeyGYLFNQYWAFQXNH-UHFFFAOYSA-N
MW285.76 g/mol
LogP2.48
Rot. Bonds3

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

N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide (PubChem CID 62997807) has the molecular formula C11H12ClN3O2S and a molecular weight of 285.76 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
PubChem CID62997807
Molecular FormulaC11H12ClN3O2S
Molecular Weight285.76 g/mol
Exact Mass285.03
IUPAC NameN-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2C)[nH]1
InChIInChI=1S/C11H12ClN3O2S/c1-7-3-4-9(12)5-10(7)15-18(16,17)11-6-13-8(2)14-11/h3-6,15H,1-2H3,(H,13,14)
InChIKeyGYLFNQYWAFQXNH-UHFFFAOYSA-N
XLogP2.48
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.76
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-iodophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 113257304
N-(5-chloro-2-propoxyphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 62999325
2-methyl-N-(2,4,6-trimethylphenyl)-1H-imidazole-5-sulfonamide
CID 62999451
N-(3-hydroxy-4-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 64794398
N-(5-chloro-2-methylphenyl)-3,4-dimethylbenzenesulfonamide
CID 2697102
3-chloro-N'-hydroxy-4-[(2-methyl-1H-imidazol-5-yl)sulfonylamino]benzenecarboximidamide
CID 107810033
N-[5-bromo-2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide
CID 62998550
N-(2-hydroxy-5-methylsulfonylphenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 81422171
2-methyl-N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
CID 63000163
N-(5-chloro-2-methylphenyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 22775093
N-(5-chloro-2-methylphenyl)-7-methyl-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
CID 20913963
N-(2,6-dibromophenyl)-2-methyl-1H-imidazole-5-sulfonamide
CID 104922595

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide (CID 62997807) is N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide is Cc1ncc(S(=O)(=O)Nc2cc(Cl)ccc2C)[nH]1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide?
The InChIKey is GYLFNQYWAFQXNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3O2S/c1-7-3-4-9(12)5-10(7)15-18(16,17)11-6-13-8(2)14-11/h3-6,15H,1-2H3,(H,13,14).
What are the key properties of N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide?
N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide has a molecular weight of 285.76 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-2-methyl-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 62997807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).