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

C12H20N4O3S — CID 103918035

IUPAC6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCCNS(=O)(=O)CCNc1ccc(C(=O)N(C)C)cn1
InChIInChI=1S/C12H20N4O3S/c1-4-15-20(18,19)8-7-13-11-6-5-10(9-14-11)12(17)16(2)3/h5-6,9,15H,4,7-8H2,1-3H3,(H,13,14)
InChIKeyIFUUNLZQURJBBQ-UHFFFAOYSA-N
MW300.38 g/mol
LogP0.13
Rot. Bonds7

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

6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 103918035) has the molecular formula C12H20N4O3S and a molecular weight of 300.38 g/mol. Its IUPAC name is 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
PubChem CID103918035
Molecular FormulaC12H20N4O3S
Molecular Weight300.38 g/mol
Exact Mass300.13
IUPAC Name6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCCNS(=O)(=O)CCNc1ccc(C(=O)N(C)C)cn1
InChIInChI=1S/C12H20N4O3S/c1-4-15-20(18,19)8-7-13-11-6-5-10(9-14-11)12(17)16(2)3/h5-6,9,15H,4,7-8H2,1-3H3,(H,13,14)
InChIKeyIFUUNLZQURJBBQ-UHFFFAOYSA-N
XLogP0.13
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-sulfonamide
CID 106338159
6-(6-hydroxyhexylamino)-N,N-dimethylpyridine-3-carboxamide
CID 103918113
6-[(2-hydroxy-2-methylbutyl)amino]-N,N-dimethylpyridine-3-carboxamide
CID 78958778
N,N-dimethyl-6-(5,5,5-trifluoropentylamino)pyridine-3-carboxamide
CID 115486588
6-[2-(4-fluorophenyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 78956160
6-[[3-(butan-2-ylamino)-3-oxopropyl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 78956162
6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide
CID 103736737
6-[2-(2-amino-2-oxoethoxy)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 106239261
N,N-dimethyl-6-[2-(2,2,2-trifluoroethoxy)ethylamino]pyridine-3-carboxamide
CID 78956359
6-[(2-hydroxy-2-propylpentyl)amino]-N,N-dimethylpyridine-3-carboxamide
CID 111435885
2-[[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]methyl]-2-ethylbutanoic acid
CID 115430029
6-[[2-ethyl-2-(hydroxymethyl)butyl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 103844430

Frequently Asked Questions

What is the IUPAC name of 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide (CID 103918035) is 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide is CCNS(=O)(=O)CCNc1ccc(C(=O)N(C)C)cn1.
What is the InChIKey of 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is IFUUNLZQURJBBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3S/c1-4-15-20(18,19)8-7-13-11-6-5-10(9-14-11)12(17)16(2)3/h5-6,9,15H,4,7-8H2,1-3H3,(H,13,14).
What are the key properties of 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide?
6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 300.38 g/mol, XLogP of 0.13, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(ethylsulfamoyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 103918035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).