5-butyl-N-methylpyridine-3-sulfonamide

C10H16N2O2S — CID 173100963

IUPAC5-butyl-N-methylpyridine-3-sulfonamide
SMILESCCCCc1cncc(S(=O)(=O)NC)c1
InChIInChI=1S/C10H16N2O2S/c1-3-4-5-9-6-10(8-12-7-9)15(13,14)11-2/h6-8,11H,3-5H2,1-2H3
InChIKeyPYUMTUVTIZVEIH-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.33
Rot. Bonds5

About 5-butyl-N-methylpyridine-3-sulfonamide

5-butyl-N-methylpyridine-3-sulfonamide (PubChem CID 173100963) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is 5-butyl-N-methylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-butyl-N-methylpyridine-3-sulfonamide
PubChem CID173100963
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name5-butyl-N-methylpyridine-3-sulfonamide
SMILESCCCCc1cncc(S(=O)(=O)NC)c1
InChIInChI=1S/C10H16N2O2S/c1-3-4-5-9-6-10(8-12-7-9)15(13,14)11-2/h6-8,11H,3-5H2,1-2H3
InChIKeyPYUMTUVTIZVEIH-UHFFFAOYSA-N
XLogP1.33
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-butyl-N-methylpyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-N-(4-butylphenyl)pyridine-3-sulfonamide
CID 63422557
5-bromo-N-methylpyridine-3-sulfonamide
CID 46738979
3-butyl-5-ethenylpyridine
CID 18679137
5-butylpyridin-3-amine;ethane;molecular hydrogen
CID 164917001
3-chloro-5-pentylpyridine
CID 59945518
3-chloro-5-octylpyridine
CID 138579116
4-butylbenzenesulfonohydrazide
CID 17255521
3,7-dibutylpyrido[3,2-g]quinoline-5,10-dione
CID 12020016
N-hexan-2-yl-5-(3-hydroxyprop-1-ynyl)pyridine-3-sulfonamide
CID 62199719
3,5-bis(5-methylhexyl)pyridine
CID 90749065
N,4-dimethyl-3-(pentylamino)benzenesulfonamide
CID 43752016
5-amino-N-butyl-N-methylpyridine-3-sulfonamide
CID 82222996

Frequently Asked Questions

What is the IUPAC name of 5-butyl-N-methylpyridine-3-sulfonamide?
The IUPAC name of 5-butyl-N-methylpyridine-3-sulfonamide (CID 173100963) is 5-butyl-N-methylpyridine-3-sulfonamide.
What is the SMILES notation for 5-butyl-N-methylpyridine-3-sulfonamide?
The canonical SMILES for 5-butyl-N-methylpyridine-3-sulfonamide is CCCCc1cncc(S(=O)(=O)NC)c1.
What is the InChIKey of 5-butyl-N-methylpyridine-3-sulfonamide?
The InChIKey is PYUMTUVTIZVEIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-3-4-5-9-6-10(8-12-7-9)15(13,14)11-2/h6-8,11H,3-5H2,1-2H3.
What are the key properties of 5-butyl-N-methylpyridine-3-sulfonamide?
5-butyl-N-methylpyridine-3-sulfonamide has a molecular weight of 228.32 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-N-methylpyridine-3-sulfonamide is sourced from PubChem (CID 173100963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).