2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide

C10H12N4O3S — CID 91621220

IUPAC2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide
SMILESCNC(=O)CNS(=O)(=O)c1nc2ccccc2[nH]1
InChIInChI=1S/C10H12N4O3S/c1-11-9(15)6-12-18(16,17)10-13-7-4-2-3-5-8(7)14-10/h2-5,12H,6H2,1H3,(H,11,15)(H,13,14)
InChIKeyFXRNTOQAPKRTLT-UHFFFAOYSA-N
MW268.30 g/mol
LogP-0.41
Rot. Bonds4

About 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide

2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide (PubChem CID 91621220) has the molecular formula C10H12N4O3S and a molecular weight of 268.30 g/mol. Its IUPAC name is 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide.

Molecular Properties

Compound Name2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide
PubChem CID91621220
Molecular FormulaC10H12N4O3S
Molecular Weight268.30 g/mol
Exact Mass268.06
IUPAC Name2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide
SMILESCNC(=O)CNS(=O)(=O)c1nc2ccccc2[nH]1
InChIInChI=1S/C10H12N4O3S/c1-11-9(15)6-12-18(16,17)10-13-7-4-2-3-5-8(7)14-10/h2-5,12H,6H2,1H3,(H,11,15)(H,13,14)
InChIKeyFXRNTOQAPKRTLT-UHFFFAOYSA-N
XLogP-0.41
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.30
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(pyridin-2-ylmethyl)-1H-benzimidazole-2-sulfonamide
CID 3087601
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(3,4-dimethylphenyl)sulfonylamino]acetamide
CID 146024065
N,N-dimethyl-1H-benzimidazole-2-sulfonamide
CID 23041875
1H-benzimidazol-2-yl(trimethyl)-λ4-sulfane
CID 123457333
2-(1H-benzimidazol-2-ylsulfonyl)-N-(3,4-dimethylphenyl)acetamide
CID 23771917
(4S)-5-(1H-benzimidazol-2-yl)-N,4-dimethylpentanamide
CID 90230596
methyl 2-(1H-benzimidazol-2-ylmethylsulfamoyl)acetate
CID 78991650
N-[[3-methyl-4-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]-1H-benzimidazole-2-sulfonamide
CID 67380172
methyl 2-[2-(1H-benzimidazol-2-yl)ethylsulfamoyl]acetate
CID 61456840
N-(1H-benzimidazol-2-ylmethyl)-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]acetamide
CID 112791038
N-(1H-benzimidazol-2-yl)-2-propylsulfonylacetamide
CID 47377841
N-[(3R)-pyrrolidin-3-yl]-1H-benzimidazole-2-sulfonamide
CID 71645830

Frequently Asked Questions

What is the IUPAC name of 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide?
The IUPAC name of 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide (CID 91621220) is 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide.
What is the SMILES notation for 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide?
The canonical SMILES for 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide is CNC(=O)CNS(=O)(=O)c1nc2ccccc2[nH]1.
What is the InChIKey of 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide?
The InChIKey is FXRNTOQAPKRTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O3S/c1-11-9(15)6-12-18(16,17)10-13-7-4-2-3-5-8(7)14-10/h2-5,12H,6H2,1H3,(H,11,15)(H,13,14).
What are the key properties of 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide?
2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide has a molecular weight of 268.30 g/mol, XLogP of -0.41, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-benzimidazol-2-ylsulfonylamino)-N-methylacetamide is sourced from PubChem (CID 91621220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).