6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide

C8H7N7O2S — CID 114613899

IUPAC6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide
SMILESCn1nnc(NS(=O)(=O)c2ccc(C#N)nc2)n1
InChIInChI=1S/C8H7N7O2S/c1-15-12-8(11-14-15)13-18(16,17)7-3-2-6(4-9)10-5-7/h2-3,5H,1H3,(H,12,13)
InChIKeyZMVGSGIFIXYKDM-UHFFFAOYSA-N
MW265.26 g/mol
LogP-0.72
Rot. Bonds3

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

6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide (PubChem CID 114613899) has the molecular formula C8H7N7O2S and a molecular weight of 265.26 g/mol. Its IUPAC name is 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide
PubChem CID114613899
Molecular FormulaC8H7N7O2S
Molecular Weight265.26 g/mol
Exact Mass265.04
IUPAC Name6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide
SMILESCn1nnc(NS(=O)(=O)c2ccc(C#N)nc2)n1
InChIInChI=1S/C8H7N7O2S/c1-15-12-8(11-14-15)13-18(16,17)7-3-2-6(4-9)10-5-7/h2-3,5H,1H3,(H,12,13)
InChIKeyZMVGSGIFIXYKDM-UHFFFAOYSA-N
XLogP-0.72
TPSA126.45 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.26
LogP ≤ 5-0.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

6-cyano-N-(4,6-dimethylpyrimidin-2-yl)pyridine-3-sulfonamide
CID 104599450
6-cyano-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide
CID 113229615
N-(2-methyltetrazol-5-yl)-4-propan-2-ylbenzenesulfonamide
CID 126829167
6-cyano-N-propylpyridine-3-sulfonamide
CID 115602408
6-cyano-N-(2,4,6-trimethylphenyl)pyridine-3-sulfonamide
CID 115602102
6-cyano-N-(3,5-dimethylphenyl)pyridine-3-sulfonamide
CID 115602138
6-cyano-N-[(2-methylcyclopentyl)methyl]pyridine-3-sulfonamide
CID 107418699
6-cyano-N-(4-iodophenyl)pyridine-3-sulfonamide
CID 115602123
6-cyano-N-(4-cyano-1H-pyrazol-5-yl)pyridine-3-sulfonamide
CID 115897741
3-hydrazinyl-N-(2-methyltetrazol-5-yl)-4-nitrobenzenesulfonamide
CID 82847860
6-cyano-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]pyridine-3-sulfonamide
CID 107848455
6-cyano-N-cyclooctylpyridine-3-sulfonamide
CID 115602393

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide (CID 114613899) is 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide is Cn1nnc(NS(=O)(=O)c2ccc(C#N)nc2)n1.
What is the InChIKey of 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide?
The InChIKey is ZMVGSGIFIXYKDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N7O2S/c1-15-12-8(11-14-15)13-18(16,17)7-3-2-6(4-9)10-5-7/h2-3,5H,1H3,(H,12,13).
What are the key properties of 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide?
6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide has a molecular weight of 265.26 g/mol, XLogP of -0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-(2-methyltetrazol-5-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 114613899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).