N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide

C15H19N5O2S — CID 69455573

IUPACN-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide
SMILESCc1cccc(NS(=O)(=O)N2CCN(c3ccccn3)CC2)n1
InChIInChI=1S/C15H19N5O2S/c1-13-5-4-6-14(17-13)18-23(21,22)20-11-9-19(10-12-20)15-7-2-3-8-16-15/h2-8H,9-12H2,1H3,(H,17,18)
InChIKeyZRSDLARSZYOZBP-UHFFFAOYSA-N
MW333.42 g/mol
LogP1.26
Rot. Bonds4

About N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide

N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide (PubChem CID 69455573) has the molecular formula C15H19N5O2S and a molecular weight of 333.42 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide
PubChem CID69455573
Molecular FormulaC15H19N5O2S
Molecular Weight333.42 g/mol
Exact Mass333.13
IUPAC NameN-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide
SMILESCc1cccc(NS(=O)(=O)N2CCN(c3ccccn3)CC2)n1
InChIInChI=1S/C15H19N5O2S/c1-13-5-4-6-14(17-13)18-23(21,22)20-11-9-19(10-12-20)15-7-2-3-8-16-15/h2-8H,9-12H2,1H3,(H,17,18)
InChIKeyZRSDLARSZYOZBP-UHFFFAOYSA-N
XLogP1.26
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.42
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide (CID 69455573) is N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide is Cc1cccc(NS(=O)(=O)N2CCN(c3ccccn3)CC2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide?
The InChIKey is ZRSDLARSZYOZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2S/c1-13-5-4-6-14(17-13)18-23(21,22)20-11-9-19(10-12-20)15-7-2-3-8-16-15/h2-8H,9-12H2,1H3,(H,17,18).
What are the key properties of N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide?
N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide has a molecular weight of 333.42 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine-1-sulfonamide is sourced from PubChem (CID 69455573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).