6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide

C11H20N4O4S2 — CID 106338159

IUPAC6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide
SMILESCCNS(=O)(=O)CCNc1ccc(S(=O)(=O)N(C)C)cn1
InChIInChI=1S/C11H20N4O4S2/c1-4-14-20(16,17)8-7-12-11-6-5-10(9-13-11)21(18,19)15(2)3/h5-6,9,14H,4,7-8H2,1-3H3,(H,12,13)
InChIKeyVGDZDQGXKLLAPK-UHFFFAOYSA-N
MW336.44 g/mol
LogP-0.32
Rot. Bonds8

About 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide

6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide (PubChem CID 106338159) has the molecular formula C11H20N4O4S2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide
PubChem CID106338159
Molecular FormulaC11H20N4O4S2
Molecular Weight336.44 g/mol
Exact Mass336.09
IUPAC Name6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide
SMILESCCNS(=O)(=O)CCNc1ccc(S(=O)(=O)N(C)C)cn1
InChIInChI=1S/C11H20N4O4S2/c1-4-14-20(16,17)8-7-12-11-6-5-10(9-13-11)21(18,19)15(2)3/h5-6,9,14H,4,7-8H2,1-3H3,(H,12,13)
InChIKeyVGDZDQGXKLLAPK-UHFFFAOYSA-N
XLogP-0.32
TPSA108.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 103918035
6-[3-(diethylamino)propylamino]-N,N-dimethylpyridine-3-sulfonamide
CID 103340951
N,N-dimethyl-6-(2-propan-2-yloxyethylamino)pyridine-3-sulfonamide
CID 104577001
N,N-dimethyl-6-[3-[methyl(propan-2-yl)amino]propylamino]pyridine-3-sulfonamide
CID 106048482
N,N-dimethyl-6-(prop-2-ynylamino)pyridine-3-sulfonamide
CID 103340991
ethyl 3-[[5-(dimethylsulfamoyl)-2-pyridinyl]amino]propanoate
CID 103340848
6-(cyclopropylmethylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 113234561
6-(2-aminopropylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 103341130
6-[(2-methoxy-2-methylpropyl)amino]-N,N-dimethylpyridine-3-sulfonamide
CID 103704076
2-[[5-(dimethylsulfamoyl)-2-pyridinyl]amino]-N-ethyl-N-methylacetamide
CID 104925729
N,N-dimethyl-6-(pyridin-4-ylmethylamino)pyridine-3-sulfonamide
CID 104999383
6-(2,2-dimethoxyethylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 107389803

Frequently Asked Questions

What is the IUPAC name of 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide?
The IUPAC name of 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide (CID 106338159) is 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide.
What is the SMILES notation for 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide?
The canonical SMILES for 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide is CCNS(=O)(=O)CCNc1ccc(S(=O)(=O)N(C)C)cn1.
What is the InChIKey of 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide?
The InChIKey is VGDZDQGXKLLAPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O4S2/c1-4-14-20(16,17)8-7-12-11-6-5-10(9-13-11)21(18,19)15(2)3/h5-6,9,14H,4,7-8H2,1-3H3,(H,12,13).
What are the key properties of 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide?
6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide has a molecular weight of 336.44 g/mol, XLogP of -0.32, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide is sourced from PubChem (CID 106338159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).