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

C10H16N2O4S — CID 114132074

IUPACN-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide
SMILESCCOCCNS(=O)(=O)c1ccc(CO)cn1
InChIInChI=1S/C10H16N2O4S/c1-2-16-6-5-12-17(14,15)10-4-3-9(8-13)7-11-10/h3-4,7,12-13H,2,5-6,8H2,1H3
InChIKeyHXHBSPKDGMZYNB-UHFFFAOYSA-N
MW260.31 g/mol
LogP-0.11
Rot. Bonds7

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

N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide (PubChem CID 114132074) has the molecular formula C10H16N2O4S and a molecular weight of 260.31 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide
PubChem CID114132074
Molecular FormulaC10H16N2O4S
Molecular Weight260.31 g/mol
Exact Mass260.08
IUPAC NameN-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide
SMILESCCOCCNS(=O)(=O)c1ccc(CO)cn1
InChIInChI=1S/C10H16N2O4S/c1-2-16-6-5-12-17(14,15)10-4-3-9(8-13)7-11-10/h3-4,7,12-13H,2,5-6,8H2,1H3
InChIKeyHXHBSPKDGMZYNB-UHFFFAOYSA-N
XLogP-0.11
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 5-0.11
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

5-(aminomethyl)-N-(2-ethoxyethyl)pyridine-2-sulfonamide
CID 106020136
N-(2-butoxyethyl)-5-(ethylaminomethyl)pyridine-2-sulfonamide
CID 106017521
N-[2-[ethyl(propyl)amino]ethyl]-5-(hydroxymethyl)pyridine-2-sulfonamide
CID 106014046
5-(hydroxymethyl)-N-(6-methylsulfanylhexyl)pyridine-2-sulfonamide
CID 106000682
5-(ethylaminomethyl)-N-(3-propoxypropyl)pyridine-2-sulfonamide
CID 106074139
5-(methylaminomethyl)-N-[2-(3-methylbutoxy)ethyl]pyridine-2-sulfonamide
CID 106018652
5-(methylaminomethyl)-N-(2-propan-2-yloxyethyl)pyridine-2-sulfonamide
CID 106077591
5-(ethylaminomethyl)-N-(5-methoxypentyl)pyridine-2-sulfonamide
CID 106092686
N-(2-ethoxyethyl)-4-hydrazinylbenzenesulfonamide
CID 43591531
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-5-(hydroxymethyl)pyridine-2-sulfonamide
CID 106377947
N-(2-ethoxyethyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62164881
5-(hydroxymethyl)-N,N-dimethylpyridine-2-sulfonamide
CID 54857460

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide?
The IUPAC name of N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide (CID 114132074) is N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide.
What is the SMILES notation for N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide?
The canonical SMILES for N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide is CCOCCNS(=O)(=O)c1ccc(CO)cn1.
What is the InChIKey of N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide?
The InChIKey is HXHBSPKDGMZYNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4S/c1-2-16-6-5-12-17(14,15)10-4-3-9(8-13)7-11-10/h3-4,7,12-13H,2,5-6,8H2,1H3.
What are the key properties of N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide?
N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide has a molecular weight of 260.31 g/mol, XLogP of -0.11, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-5-(hydroxymethyl)pyridine-2-sulfonamide is sourced from PubChem (CID 114132074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).