5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide

C10H17N3O3S — CID 106020136

IUPAC5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide
SMILESCCOCCNS(=O)(=O)c1ccc(CN)cn1
InChIInChI=1S/C10H17N3O3S/c1-2-16-6-5-13-17(14,15)10-4-3-9(7-11)8-12-10/h3-4,8,13H,2,5-7,11H2,1H3
InChIKeyCTNPIYVDEBNBLP-UHFFFAOYSA-N
MW259.33 g/mol
LogP-0.14
Rot. Bonds7

About 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide

5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide (PubChem CID 106020136) has the molecular formula C10H17N3O3S and a molecular weight of 259.33 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide
PubChem CID106020136
Molecular FormulaC10H17N3O3S
Molecular Weight259.33 g/mol
Exact Mass259.10
IUPAC Name5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide
SMILESCCOCCNS(=O)(=O)c1ccc(CN)cn1
InChIInChI=1S/C10H17N3O3S/c1-2-16-6-5-13-17(14,15)10-4-3-9(7-11)8-12-10/h3-4,8,13H,2,5-7,11H2,1H3
InChIKeyCTNPIYVDEBNBLP-UHFFFAOYSA-N
XLogP-0.14
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 ≤ 5-0.14
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

N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide
CID 114132074
N-(2-butoxyethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide
CID 106017521
4-(aminomethyl)-2-chloro-N-(2-ethoxyethyl)benzenesulfonamide
CID 113370382
5-(aminomethyl)-N-(2-thiophen-3-ylethyl)pyridine-2-sulfonamide
CID 106050116
5-(methylaminomethyl)-N-[2-(3-methylbutoxy)ethyl]pyridine-2-sulfonamide
CID 106018652
2-(aminomethyl)-N-(2-ethoxyethyl)pyridine-3-sulfonamide
CID 106593983
5-(methylaminomethyl)-N-(2-propan-2-yloxyethyl)pyridine-2-sulfonamide
CID 106077591
5-(ethylaminomethyl)-N-(3-propoxypropyl)pyridine-2-sulfonamide
CID 106074139
4-(aminomethyl)-N-(2-ethoxyethyl)-1H-pyrazole-5-sulfonamide
CID 106019742
N-(2-ethoxyethyl)-4-hydrazinylbenzenesulfonamide
CID 43591531
5-(aminomethyl)-N-(4-imidazol-1-ylbutyl)pyridine-2-sulfonamide
CID 106054447
5-(ethylaminomethyl)-N-(5-methoxypentyl)pyridine-2-sulfonamide
CID 106092686

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide (CID 106020136) is 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide is CCOCCNS(=O)(=O)c1ccc(CN)cn1.
What is the InChIKey of 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide?
The InChIKey is CTNPIYVDEBNBLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S/c1-2-16-6-5-13-17(14,15)10-4-3-9(7-11)8-12-10/h3-4,8,13H,2,5-7,11H2,1H3.
What are the key properties of 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide?
5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide has a molecular weight of 259.33 g/mol, XLogP of -0.14, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide is sourced from PubChem (CID 106020136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).