N-(2-methoxyethoxy)oxane-4-sulfonamide

C8H17NO5S — CID 82715938

IUPACN-(2-methoxyethoxy)oxane-4-sulfonamide
SMILESCOCCONS(=O)(=O)C1CCOCC1
InChIInChI=1S/C8H17NO5S/c1-12-6-7-14-9-15(10,11)8-2-4-13-5-3-8/h8-9H,2-7H2,1H3
InChIKeyDLFANOMCVFNKBJ-UHFFFAOYSA-N
MW239.29 g/mol
LogP-0.34
Rot. Bonds6

About N-(2-methoxyethoxy)oxane-4-sulfonamide

N-(2-methoxyethoxy)oxane-4-sulfonamide (PubChem CID 82715938) has the molecular formula C8H17NO5S and a molecular weight of 239.29 g/mol. Its IUPAC name is N-(2-methoxyethoxy)oxane-4-sulfonamide.

Molecular Properties

Compound NameN-(2-methoxyethoxy)oxane-4-sulfonamide
PubChem CID82715938
Molecular FormulaC8H17NO5S
Molecular Weight239.29 g/mol
Exact Mass239.08
IUPAC NameN-(2-methoxyethoxy)oxane-4-sulfonamide
SMILESCOCCONS(=O)(=O)C1CCOCC1
InChIInChI=1S/C8H17NO5S/c1-12-6-7-14-9-15(10,11)8-2-4-13-5-3-8/h8-9H,2-7H2,1H3
InChIKeyDLFANOMCVFNKBJ-UHFFFAOYSA-N
XLogP-0.34
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.29
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethoxy)oxane-4-sulfonamide?
The IUPAC name of N-(2-methoxyethoxy)oxane-4-sulfonamide (CID 82715938) is N-(2-methoxyethoxy)oxane-4-sulfonamide.
What is the SMILES notation for N-(2-methoxyethoxy)oxane-4-sulfonamide?
The canonical SMILES for N-(2-methoxyethoxy)oxane-4-sulfonamide is COCCONS(=O)(=O)C1CCOCC1.
What is the InChIKey of N-(2-methoxyethoxy)oxane-4-sulfonamide?
The InChIKey is DLFANOMCVFNKBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO5S/c1-12-6-7-14-9-15(10,11)8-2-4-13-5-3-8/h8-9H,2-7H2,1H3.
What are the key properties of N-(2-methoxyethoxy)oxane-4-sulfonamide?
N-(2-methoxyethoxy)oxane-4-sulfonamide has a molecular weight of 239.29 g/mol, XLogP of -0.34, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethoxy)oxane-4-sulfonamide is sourced from PubChem (CID 82715938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).