2-methylpyridine-3-sulfonamide

C6H8N2O2S — CID 22409057

IUPAC2-methylpyridine-3-sulfonamide
SMILESCc1ncccc1S(N)(=O)=O
InChIInChI=1S/C6H8N2O2S/c1-5-6(11(7,9)10)3-2-4-8-5/h2-4H,1H3,(H2,7,9,10)
InChIKeyDAHOYMNLSWLDGQ-UHFFFAOYSA-N
MW172.21 g/mol
LogP0.04
Rot. Bonds1

About 2-methylpyridine-3-sulfonamide

2-methylpyridine-3-sulfonamide (PubChem CID 22409057) has the molecular formula C6H8N2O2S and a molecular weight of 172.21 g/mol. Its IUPAC name is 2-methylpyridine-3-sulfonamide.

Molecular Properties

Compound Name2-methylpyridine-3-sulfonamide
PubChem CID22409057
Molecular FormulaC6H8N2O2S
Molecular Weight172.21 g/mol
Exact Mass172.03
IUPAC Name2-methylpyridine-3-sulfonamide
SMILESCc1ncccc1S(N)(=O)=O
InChIInChI=1S/C6H8N2O2S/c1-5-6(11(7,9)10)3-2-4-8-5/h2-4H,1H3,(H2,7,9,10)
InChIKeyDAHOYMNLSWLDGQ-UHFFFAOYSA-N
XLogP0.04
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.21
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methylpyridine-3-sulfonamide?
The IUPAC name of 2-methylpyridine-3-sulfonamide (CID 22409057) is 2-methylpyridine-3-sulfonamide.
What is the SMILES notation for 2-methylpyridine-3-sulfonamide?
The canonical SMILES for 2-methylpyridine-3-sulfonamide is Cc1ncccc1S(N)(=O)=O.
What is the InChIKey of 2-methylpyridine-3-sulfonamide?
The InChIKey is DAHOYMNLSWLDGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2S/c1-5-6(11(7,9)10)3-2-4-8-5/h2-4H,1H3,(H2,7,9,10).
What are the key properties of 2-methylpyridine-3-sulfonamide?
2-methylpyridine-3-sulfonamide has a molecular weight of 172.21 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpyridine-3-sulfonamide is sourced from PubChem (CID 22409057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).