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

C10H11N3O2S — CID 3658049

IUPACN-(3-methylphenyl)-1H-imidazole-5-sulfonamide
SMILESCc1cccc(NS(=O)(=O)c2cnc[nH]2)c1
InChIInChI=1S/C10H11N3O2S/c1-8-3-2-4-9(5-8)13-16(14,15)10-6-11-7-12-10/h2-7,13H,1H3,(H,11,12)
InChIKeyALVSNNUPRJHTDB-UHFFFAOYSA-N
MW237.28 g/mol
LogP1.52
Rot. Bonds3

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

N-(3-methylphenyl)-1H-imidazole-5-sulfonamide (PubChem CID 3658049) has the molecular formula C10H11N3O2S and a molecular weight of 237.28 g/mol. Its IUPAC name is N-(3-methylphenyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-1H-imidazole-5-sulfonamide
PubChem CID3658049
Molecular FormulaC10H11N3O2S
Molecular Weight237.28 g/mol
Exact Mass237.06
IUPAC NameN-(3-methylphenyl)-1H-imidazole-5-sulfonamide
SMILESCc1cccc(NS(=O)(=O)c2cnc[nH]2)c1
InChIInChI=1S/C10H11N3O2S/c1-8-3-2-4-9(5-8)13-16(14,15)10-6-11-7-12-10/h2-7,13H,1H3,(H,11,12)
InChIKeyALVSNNUPRJHTDB-UHFFFAOYSA-N
XLogP1.52
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 51.52
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
N-(3-amino-4-bromophenyl)-1H-imidazole-5-sulfonamide
CID 79768373
N-[4-(1H-imidazol-5-yl)phenyl]-3-methylbenzenesulfonamide
CID 84512955
N-[3-(1H-imidazol-5-yl)phenyl]-2,4,6-trimethylbenzenesulfonamide
CID 110668633
N-(3-methyl-2-oxo-1H-quinolin-6-yl)-1H-imidazole-5-sulfonamide
CID 71271553
N-(3-bromo-4-nitrophenyl)-1H-imidazole-5-sulfonamide
CID 82864859
N-[3-(6-propan-2-ylquinolin-2-yl)phenyl]-1H-imidazole-5-sulfonamide
CID 50816850
2,3,4,5,6-pentafluoro-N-(3-methylphenyl)benzenesulfonamide
CID 20703904
4-methyl-N-(3-methylphenyl)benzenesulfonamide fluoride
CID 21210525
N-(3-methylphenyl)-3-[3-[(3-methylphenyl)sulfamoyl]phenyl]sulfonylbenzenesulfonamide
CID 3091379
N-[4-[(propan-2-ylamino)methyl]phenyl]-1H-imidazole-5-sulfonamide
CID 106911204
(3-methylphenyl)sulfamic acid
CID 10307955

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(3-methylphenyl)-1H-imidazole-5-sulfonamide (CID 3658049) is N-(3-methylphenyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(3-methylphenyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(3-methylphenyl)-1H-imidazole-5-sulfonamide is Cc1cccc(NS(=O)(=O)c2cnc[nH]2)c1.
What is the InChIKey of N-(3-methylphenyl)-1H-imidazole-5-sulfonamide?
The InChIKey is ALVSNNUPRJHTDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2S/c1-8-3-2-4-9(5-8)13-16(14,15)10-6-11-7-12-10/h2-7,13H,1H3,(H,11,12).
What are the key properties of N-(3-methylphenyl)-1H-imidazole-5-sulfonamide?
N-(3-methylphenyl)-1H-imidazole-5-sulfonamide has a molecular weight of 237.28 g/mol, XLogP of 1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 3658049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).