N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide

C15H17N3O3S — CID 18582823

IUPACN-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide
SMILESO=C(NCCS(=O)(=O)NCc1ccccn1)c1ccccc1
InChIInChI=1S/C15H17N3O3S/c19-15(13-6-2-1-3-7-13)17-10-11-22(20,21)18-12-14-8-4-5-9-16-14/h1-9,18H,10-12H2,(H,17,19)
InChIKeyZNHYPFGKXGGSHS-UHFFFAOYSA-N
MW319.39 g/mol
LogP0.93
Rot. Bonds7

About N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide

N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide (PubChem CID 18582823) has the molecular formula C15H17N3O3S and a molecular weight of 319.39 g/mol. Its IUPAC name is N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide.

Molecular Properties

Compound NameN-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide
PubChem CID18582823
Molecular FormulaC15H17N3O3S
Molecular Weight319.39 g/mol
Exact Mass319.10
IUPAC NameN-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide
SMILESO=C(NCCS(=O)(=O)NCc1ccccn1)c1ccccc1
InChIInChI=1S/C15H17N3O3S/c19-15(13-6-2-1-3-7-13)17-10-11-22(20,21)18-12-14-8-4-5-9-16-14/h1-9,18H,10-12H2,(H,17,19)
InChIKeyZNHYPFGKXGGSHS-UHFFFAOYSA-N
XLogP0.93
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide?
The IUPAC name of N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide (CID 18582823) is N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide.
What is the SMILES notation for N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide?
The canonical SMILES for N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide is O=C(NCCS(=O)(=O)NCc1ccccn1)c1ccccc1.
What is the InChIKey of N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide?
The InChIKey is ZNHYPFGKXGGSHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3S/c19-15(13-6-2-1-3-7-13)17-10-11-22(20,21)18-12-14-8-4-5-9-16-14/h1-9,18H,10-12H2,(H,17,19).
What are the key properties of N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide?
N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide has a molecular weight of 319.39 g/mol, XLogP of 0.93, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(pyridin-2-ylmethylsulfamoyl)ethyl]benzamide is sourced from PubChem (CID 18582823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).