N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide

C7H17NO4S — CID 176560121

IUPACN-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide
SMILESCCOCCOCCNS(C)(=O)=O
InChIInChI=1S/C7H17NO4S/c1-3-11-6-7-12-5-4-8-13(2,9)10/h8H,3-7H2,1-2H3
InChIKeyQNBAZZCSJTZKBC-UHFFFAOYSA-N
MW211.28 g/mol
LogP-0.41
Rot. Bonds8

About N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide

N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide (PubChem CID 176560121) has the molecular formula C7H17NO4S and a molecular weight of 211.28 g/mol. Its IUPAC name is N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide
PubChem CID176560121
Molecular FormulaC7H17NO4S
Molecular Weight211.28 g/mol
Exact Mass211.09
IUPAC NameN-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide
SMILESCCOCCOCCNS(C)(=O)=O
InChIInChI=1S/C7H17NO4S/c1-3-11-6-7-12-5-4-8-13(2,9)10/h8H,3-7H2,1-2H3
InChIKeyQNBAZZCSJTZKBC-UHFFFAOYSA-N
XLogP-0.41
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.28
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-ethoxyethoxy)ethyl]methanesulfonamide?
The IUPAC name of N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide (CID 176560121) is N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide?
The canonical SMILES for N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide is CCOCCOCCNS(C)(=O)=O.
What is the InChIKey of N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide?
The InChIKey is QNBAZZCSJTZKBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO4S/c1-3-11-6-7-12-5-4-8-13(2,9)10/h8H,3-7H2,1-2H3.
What are the key properties of N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide?
N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide has a molecular weight of 211.28 g/mol, XLogP of -0.41, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide is sourced from PubChem (CID 176560121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).