N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide

C11H18N4O3S — CID 74250724

IUPACN-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncccc1C(=O)NCCS(=O)(=O)N(C)C
InChIInChI=1S/C11H18N4O3S/c1-12-10-9(5-4-6-13-10)11(16)14-7-8-19(17,18)15(2)3/h4-6H,7-8H2,1-3H3,(H,12,13)(H,14,16)
InChIKeyAWWRKNLAGFYQTB-UHFFFAOYSA-N
MW286.36 g/mol
LogP-0.26
Rot. Bonds6

About N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide

N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide (PubChem CID 74250724) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide
PubChem CID74250724
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC NameN-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncccc1C(=O)NCCS(=O)(=O)N(C)C
InChIInChI=1S/C11H18N4O3S/c1-12-10-9(5-4-6-13-10)11(16)14-7-8-19(17,18)15(2)3/h4-6H,7-8H2,1-3H3,(H,12,13)(H,14,16)
InChIKeyAWWRKNLAGFYQTB-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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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide (CID 74250724) is N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide is CNc1ncccc1C(=O)NCCS(=O)(=O)N(C)C.
What is the InChIKey of N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide?
The InChIKey is AWWRKNLAGFYQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-12-10-9(5-4-6-13-10)11(16)14-7-8-19(17,18)15(2)3/h4-6H,7-8H2,1-3H3,(H,12,13)(H,14,16).
What are the key properties of N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-carboxamide?
N-[2-(dimethylsulfamoyl)ethyl]-2-(methylamino)pyridine-3-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]-2-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 74250724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).