N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide

C11H11N3O2S — CID 24761729

IUPACN-(pyridin-2-ylmethyl)pyridine-2-sulfonamide
SMILESO=S(=O)(NCc1ccccn1)c1ccccn1
InChIInChI=1S/C11H11N3O2S/c15-17(16,11-6-2-4-8-13-11)14-9-10-5-1-3-7-12-10/h1-8,14H,9H2
InChIKeyFIMBACCQNCEWEO-UHFFFAOYSA-N
MW249.30 g/mol
LogP0.96
Rot. Bonds4

About N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide

N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide (PubChem CID 24761729) has the molecular formula C11H11N3O2S and a molecular weight of 249.30 g/mol. Its IUPAC name is N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(pyridin-2-ylmethyl)pyridine-2-sulfonamide
PubChem CID24761729
Molecular FormulaC11H11N3O2S
Molecular Weight249.30 g/mol
Exact Mass249.06
IUPAC NameN-(pyridin-2-ylmethyl)pyridine-2-sulfonamide
SMILESO=S(=O)(NCc1ccccn1)c1ccccn1
InChIInChI=1S/C11H11N3O2S/c15-17(16,11-6-2-4-8-13-11)14-9-10-5-1-3-7-12-10/h1-8,14H,9H2
InChIKeyFIMBACCQNCEWEO-UHFFFAOYSA-N
XLogP0.96
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide?
The IUPAC name of N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide (CID 24761729) is N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide.
What is the SMILES notation for N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide?
The canonical SMILES for N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide is O=S(=O)(NCc1ccccn1)c1ccccn1.
What is the InChIKey of N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide?
The InChIKey is FIMBACCQNCEWEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2S/c15-17(16,11-6-2-4-8-13-11)14-9-10-5-1-3-7-12-10/h1-8,14H,9H2.
What are the key properties of N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide?
N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide has a molecular weight of 249.30 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide is sourced from PubChem (CID 24761729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).