N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide

C8H19NO5S — CID 58734331

IUPACN-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide
SMILESCOCCOCCOCCNS(C)(=O)=O
InChIInChI=1S/C8H19NO5S/c1-12-5-6-14-8-7-13-4-3-9-15(2,10)11/h9H,3-8H2,1-2H3
InChIKeyQBMVDBCRERVKQR-UHFFFAOYSA-N
MW241.31 g/mol
LogP-0.78
Rot. Bonds10

About N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide

N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide (PubChem CID 58734331) has the molecular formula C8H19NO5S and a molecular weight of 241.31 g/mol. Its IUPAC name is N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide
PubChem CID58734331
Molecular FormulaC8H19NO5S
Molecular Weight241.31 g/mol
Exact Mass241.10
IUPAC NameN-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide
SMILESCOCCOCCOCCNS(C)(=O)=O
InChIInChI=1S/C8H19NO5S/c1-12-5-6-14-8-7-13-4-3-9-15(2,10)11/h9H,3-8H2,1-2H3
InChIKeyQBMVDBCRERVKQR-UHFFFAOYSA-N
XLogP-0.78
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 5-0.78
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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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide?
The IUPAC name of N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide (CID 58734331) is N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide?
The canonical SMILES for N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide is COCCOCCOCCNS(C)(=O)=O.
What is the InChIKey of N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide?
The InChIKey is QBMVDBCRERVKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO5S/c1-12-5-6-14-8-7-13-4-3-9-15(2,10)11/h9H,3-8H2,1-2H3.
What are the key properties of N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide?
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide has a molecular weight of 241.31 g/mol, XLogP of -0.78, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]methanesulfonamide is sourced from PubChem (CID 58734331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).