3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide

C10H17N3O3S — CID 103305180

IUPAC3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide
SMILESCOCCCCNS(=O)(=O)c1ncccc1N
InChIInChI=1S/C10H17N3O3S/c1-16-8-3-2-7-13-17(14,15)10-9(11)5-4-6-12-10/h4-6,13H,2-3,7-8,11H2,1H3
InChIKeyQKXGRJMOMKSWQF-UHFFFAOYSA-N
MW259.33 g/mol
LogP0.37
Rot. Bonds7

About 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide

3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide (PubChem CID 103305180) has the molecular formula C10H17N3O3S and a molecular weight of 259.33 g/mol. Its IUPAC name is 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide
PubChem CID103305180
Molecular FormulaC10H17N3O3S
Molecular Weight259.33 g/mol
Exact Mass259.10
IUPAC Name3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide
SMILESCOCCCCNS(=O)(=O)c1ncccc1N
InChIInChI=1S/C10H17N3O3S/c1-16-8-3-2-7-13-17(14,15)10-9(11)5-4-6-12-10/h4-6,13H,2-3,7-8,11H2,1H3
InChIKeyQKXGRJMOMKSWQF-UHFFFAOYSA-N
XLogP0.37
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-amino-N-(2-methoxyethyl)pyridine-2-sulfonamide
CID 103303676
3-amino-N-decylpyridine-2-sulfonamide
CID 103306537
3-[(3-amino-2-pyridinyl)sulfonylamino]-N-(2-methoxyethyl)propanamide
CID 103307140
2-(4-methoxybutylsulfonyl)pyridin-3-amine
CID 104648972
2-(aminomethyl)-N-(4-methoxybutyl)pyridine-3-sulfonamide
CID 106594289
3-amino-N-[2-(3-methylbutoxy)ethyl]pyridine-2-sulfonamide
CID 103305551
3-amino-N-[2-(ethylsulfamoyl)ethyl]pyridine-2-sulfonamide
CID 106342302
3-amino-N-[2-(2,2-difluoroethoxy)ethyl]pyridine-2-sulfonamide
CID 114129366
3-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 104742127
3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide
CID 103306499
3-amino-N-(2-cyclohexyloxyethyl)pyridine-2-sulfonamide
CID 103306082
3-amino-N-propan-2-ylpyridine-2-sulfonamide
CID 103303655

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide?
The IUPAC name of 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide (CID 103305180) is 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide?
The canonical SMILES for 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide is COCCCCNS(=O)(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide?
The InChIKey is QKXGRJMOMKSWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S/c1-16-8-3-2-7-13-17(14,15)10-9(11)5-4-6-12-10/h4-6,13H,2-3,7-8,11H2,1H3.
What are the key properties of 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide?
3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide has a molecular weight of 259.33 g/mol, XLogP of 0.37, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide is sourced from PubChem (CID 103305180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).