N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide

C12H16N4O2S — CID 63903278

IUPACN-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2ccccc2N(C)C)[nH]1
InChIInChI=1S/C12H16N4O2S/c1-9-13-8-12(14-9)19(17,18)15-10-6-4-5-7-11(10)16(2)3/h4-8,15H,1-3H3,(H,13,14)
InChIKeyBVXSWLGBMJKGLW-UHFFFAOYSA-N
MW280.35 g/mol
LogP1.58
Rot. Bonds4

About N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide

N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide (PubChem CID 63903278) has the molecular formula C12H16N4O2S and a molecular weight of 280.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide
PubChem CID63903278
Molecular FormulaC12H16N4O2S
Molecular Weight280.35 g/mol
Exact Mass280.10
IUPAC NameN-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2ccccc2N(C)C)[nH]1
InChIInChI=1S/C12H16N4O2S/c1-9-13-8-12(14-9)19(17,18)15-10-6-4-5-7-11(10)16(2)3/h4-8,15H,1-3H3,(H,13,14)
InChIKeyBVXSWLGBMJKGLW-UHFFFAOYSA-N
XLogP1.58
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide?
The IUPAC name of N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide (CID 63903278) is N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide is Cc1ncc(S(=O)(=O)Nc2ccccc2N(C)C)[nH]1.
What is the InChIKey of N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide?
The InChIKey is BVXSWLGBMJKGLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2S/c1-9-13-8-12(14-9)19(17,18)15-10-6-4-5-7-11(10)16(2)3/h4-8,15H,1-3H3,(H,13,14).
What are the key properties of N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide?
N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide has a molecular weight of 280.35 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)phenyl]-2-methyl-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 63903278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).