N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide

C11H18N4O3S — CID 106342692

IUPACN-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccnc(C(=O)NCCS(=O)(=O)N(C)C)c1
InChIInChI=1S/C11H18N4O3S/c1-12-9-4-5-13-10(8-9)11(16)14-6-7-19(17,18)15(2)3/h4-5,8H,6-7H2,1-3H3,(H,12,13)(H,14,16)
InChIKeyQCIVGNCNUYYOBH-UHFFFAOYSA-N
MW286.36 g/mol
LogP-0.26
Rot. Bonds6

About N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide

N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide (PubChem CID 106342692) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide
PubChem CID106342692
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC NameN-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccnc(C(=O)NCCS(=O)(=O)N(C)C)c1
InChIInChI=1S/C11H18N4O3S/c1-12-9-4-5-13-10(8-9)11(16)14-6-7-19(17,18)15(2)3/h4-5,8H,6-7H2,1-3H3,(H,12,13)(H,14,16)
InChIKeyQCIVGNCNUYYOBH-UHFFFAOYSA-N
XLogP-0.26
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(methylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-2-carboxamide
CID 62178459
2-amino-N-[2-(dimethylsulfamoyl)ethyl]pyridine-4-carboxamide
CID 106342687
4-(methylamino)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 62181098
4-(ethylamino)-N-[2-(ethylsulfamoyl)ethyl]pyridine-2-carboxamide
CID 106342560
N-(2-butoxyethyl)-4-(methylamino)pyridine-2-carboxamide
CID 62177424
4-(methylamino)-N-(3-phenylbutyl)pyridine-2-carboxamide
CID 62986653
6-chloro-N-[2-(dimethylsulfamoyl)ethyl]pyridazine-3-carboxamide
CID 114175119
N-[2-(ethylsulfamoyl)ethyl]-4-(propylamino)pyridine-2-carboxamide
CID 106342591
N-methyl-4-(methylamino)-N-propylpyridine-2-carboxamide
CID 62170346
4-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyridine-2-carboxamide
CID 109207266
4-(tert-butylamino)-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 109207144
N-(cyclohexylmethyl)-4-(methylamino)pyridine-2-carboxamide
CID 62169507

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide (CID 106342692) is N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide is CNc1ccnc(C(=O)NCCS(=O)(=O)N(C)C)c1.
What is the InChIKey of N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide?
The InChIKey is QCIVGNCNUYYOBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-12-9-4-5-13-10(8-9)11(16)14-6-7-19(17,18)15(2)3/h4-5,8H,6-7H2,1-3H3,(H,12,13)(H,14,16).
What are the key properties of N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide?
N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide has a molecular weight of 286.36 g/mol, XLogP of -0.26, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylsulfamoyl)ethyl]-4-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 106342692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).