6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide

C12H7N5O2S — CID 115662563

IUPAC6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2ccc(C#N)nc2)nc1
InChIInChI=1S/C12H7N5O2S/c13-5-9-1-4-12(16-7-9)17-20(18,19)11-3-2-10(6-14)15-8-11/h1-4,7-8H,(H,16,17)
InChIKeyASIJMHIPMRLNFI-UHFFFAOYSA-N
MW285.29 g/mol
LogP1.02
Rot. Bonds3

About 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide

6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide (PubChem CID 115662563) has the molecular formula C12H7N5O2S and a molecular weight of 285.29 g/mol. Its IUPAC name is 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide
PubChem CID115662563
Molecular FormulaC12H7N5O2S
Molecular Weight285.29 g/mol
Exact Mass285.03
IUPAC Name6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide
SMILESN#Cc1ccc(NS(=O)(=O)c2ccc(C#N)nc2)nc1
InChIInChI=1S/C12H7N5O2S/c13-5-9-1-4-12(16-7-9)17-20(18,19)11-3-2-10(6-14)15-8-11/h1-4,7-8H,(H,16,17)
InChIKeyASIJMHIPMRLNFI-UHFFFAOYSA-N
XLogP1.02
TPSA119.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.29
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Sulfapyridine
CID 5336
N-(4-Methyl-2-pyridyl)benzenesulfonamide
CID 739341
N-[5-(trifluoromethyl)pyridin-2-yl]benzenesulfonamide
CID 2815858
4-Methyl-N-pyridin-2-YL-benzenesulfonamide
CID 402911
N-[5-(6-amino-3-pyridinyl)-2-methyl-3-pyridinyl]benzenesulfonamide
CID 141461664
N,N-diethyl-6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-sulfonamide
CID 4879849
N,N-diethyl-6-[(2E)-2-(1-pyridin-3-ylethylidene)hydrazinyl]pyridine-3-sulfonamide
CID 9677341
4-(4-cyanophenyl)-N-pyridin-2-ylbenzenesulfonamide
CID 71579869
4-(3-cyano-2-pyridinyl)-N-(4-sulfamoylphenyl)piperazine-1-carboxamide
CID 122187642
4-Fluoro-N-(5-methyl-pyridin-2-yl)-benzenesulfonamide
CID 793818
4-Ethyl-N-2-pyridinylbenzenesulfonamide
CID 961408
N,N-diethyl-6-(pyridin-2-ylmethylamino)pyridine-3-sulfonamide
CID 4799617

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide?
The IUPAC name of 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide (CID 115662563) is 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide is N#Cc1ccc(NS(=O)(=O)c2ccc(C#N)nc2)nc1.
What is the InChIKey of 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide?
The InChIKey is ASIJMHIPMRLNFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7N5O2S/c13-5-9-1-4-12(16-7-9)17-20(18,19)11-3-2-10(6-14)15-8-11/h1-4,7-8H,(H,16,17).
What are the key properties of 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide?
6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide has a molecular weight of 285.29 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-(5-cyano-2-pyridinyl)pyridine-3-sulfonamide is sourced from PubChem (CID 115662563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).