6-(2-phenoxyethoxy)pyridine-3-sulfonamide

C13H14N2O4S — CID 115928056

IUPAC6-(2-phenoxyethoxy)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1ccc(OCCOc2ccccc2)nc1
InChIInChI=1S/C13H14N2O4S/c14-20(16,17)12-6-7-13(15-10-12)19-9-8-18-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,14,16,17)
InChIKeyOPVFCXDQYKHHGI-UHFFFAOYSA-N
MW294.33 g/mol
LogP1.19
Rot. Bonds6

About 6-(2-phenoxyethoxy)pyridine-3-sulfonamide

6-(2-phenoxyethoxy)pyridine-3-sulfonamide (PubChem CID 115928056) has the molecular formula C13H14N2O4S and a molecular weight of 294.33 g/mol. Its IUPAC name is 6-(2-phenoxyethoxy)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(2-phenoxyethoxy)pyridine-3-sulfonamide
PubChem CID115928056
Molecular FormulaC13H14N2O4S
Molecular Weight294.33 g/mol
Exact Mass294.07
IUPAC Name6-(2-phenoxyethoxy)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1ccc(OCCOc2ccccc2)nc1
InChIInChI=1S/C13H14N2O4S/c14-20(16,17)12-6-7-13(15-10-12)19-9-8-18-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,14,16,17)
InChIKeyOPVFCXDQYKHHGI-UHFFFAOYSA-N
XLogP1.19
TPSA91.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6-(2-propoxyethoxy)pyridine-3-sulfonamide
CID 112572750
6-(4-ethoxyphenoxy)pyridine-3-sulfonamide
CID 115928029
6-naphthalen-1-yloxypyridine-3-sulfonamide
CID 115928043
2-phenoxyethanesulfonamide
CID 54595861
6-(3,5-dimethoxyphenoxy)pyridine-3-sulfonamide
CID 115928101
4-(2-phenoxyethylamino)benzene-1,3-disulfonamide
CID 68803331
6-(2-propan-2-ylphenoxy)pyridine-3-sulfonamide
CID 115928047
6-(2-cyanophenoxy)pyridine-3-sulfonamide
CID 112683212
6-(3,4-difluorophenoxy)pyridine-3-sulfonamide
CID 112572688
4-(2-pyridin-4-ylethoxy)benzenesulfonamide
CID 82910996
6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-sulfonamide
CID 112572780
3-(2-phenoxyethoxy)-N-(4-sulfamoylphenyl)benzamide
CID 4954916

Frequently Asked Questions

What is the IUPAC name of 6-(2-phenoxyethoxy)pyridine-3-sulfonamide?
The IUPAC name of 6-(2-phenoxyethoxy)pyridine-3-sulfonamide (CID 115928056) is 6-(2-phenoxyethoxy)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(2-phenoxyethoxy)pyridine-3-sulfonamide?
The canonical SMILES for 6-(2-phenoxyethoxy)pyridine-3-sulfonamide is NS(=O)(=O)c1ccc(OCCOc2ccccc2)nc1.
What is the InChIKey of 6-(2-phenoxyethoxy)pyridine-3-sulfonamide?
The InChIKey is OPVFCXDQYKHHGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4S/c14-20(16,17)12-6-7-13(15-10-12)19-9-8-18-11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H2,14,16,17).
What are the key properties of 6-(2-phenoxyethoxy)pyridine-3-sulfonamide?
6-(2-phenoxyethoxy)pyridine-3-sulfonamide has a molecular weight of 294.33 g/mol, XLogP of 1.19, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-phenoxyethoxy)pyridine-3-sulfonamide is sourced from PubChem (CID 115928056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).