N,N-dimethyl-1H-benzimidazole-2-sulfonamide

C9H11N3O2S — CID 23041875

IUPACN,N-dimethyl-1H-benzimidazole-2-sulfonamide
SMILESCN(C)S(=O)(=O)c1nc2ccccc2[nH]1
InChIInChI=1S/C9H11N3O2S/c1-12(2)15(13,14)9-10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3,(H,10,11)
InChIKeyGVARAPXTYKXZCY-UHFFFAOYSA-N
MW225.27 g/mol
LogP0.81
Rot. Bonds2

About N,N-dimethyl-1H-benzimidazole-2-sulfonamide

N,N-dimethyl-1H-benzimidazole-2-sulfonamide (PubChem CID 23041875) has the molecular formula C9H11N3O2S and a molecular weight of 225.27 g/mol. Its IUPAC name is N,N-dimethyl-1H-benzimidazole-2-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-1H-benzimidazole-2-sulfonamide
PubChem CID23041875
Molecular FormulaC9H11N3O2S
Molecular Weight225.27 g/mol
Exact Mass225.06
IUPAC NameN,N-dimethyl-1H-benzimidazole-2-sulfonamide
SMILESCN(C)S(=O)(=O)c1nc2ccccc2[nH]1
InChIInChI=1S/C9H11N3O2S/c1-12(2)15(13,14)9-10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3,(H,10,11)
InChIKeyGVARAPXTYKXZCY-UHFFFAOYSA-N
XLogP0.81
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1H-benzimidazole-2-sulfonamide?
The IUPAC name of N,N-dimethyl-1H-benzimidazole-2-sulfonamide (CID 23041875) is N,N-dimethyl-1H-benzimidazole-2-sulfonamide.
What is the SMILES notation for N,N-dimethyl-1H-benzimidazole-2-sulfonamide?
The canonical SMILES for N,N-dimethyl-1H-benzimidazole-2-sulfonamide is CN(C)S(=O)(=O)c1nc2ccccc2[nH]1.
What is the InChIKey of N,N-dimethyl-1H-benzimidazole-2-sulfonamide?
The InChIKey is GVARAPXTYKXZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2S/c1-12(2)15(13,14)9-10-7-5-3-4-6-8(7)11-9/h3-6H,1-2H3,(H,10,11).
What are the key properties of N,N-dimethyl-1H-benzimidazole-2-sulfonamide?
N,N-dimethyl-1H-benzimidazole-2-sulfonamide has a molecular weight of 225.27 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1H-benzimidazole-2-sulfonamide is sourced from PubChem (CID 23041875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).