N-(2-ethoxyethyl)-N-ethylmethanesulfonamide

C7H17NO3S — CID 63933892

IUPACN-(2-ethoxyethyl)-N-ethylmethanesulfonamide
SMILESCCOCCN(CC)S(C)(=O)=O
InChIInChI=1S/C7H17NO3S/c1-4-8(12(3,9)10)6-7-11-5-2/h4-7H2,1-3H3
InChIKeyFWQNJGRTRHHNEM-UHFFFAOYSA-N
MW195.28 g/mol
LogP0.30
Rot. Bonds6

About N-(2-ethoxyethyl)-N-ethylmethanesulfonamide

N-(2-ethoxyethyl)-N-ethylmethanesulfonamide (PubChem CID 63933892) has the molecular formula C7H17NO3S and a molecular weight of 195.28 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N-ethylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N-ethylmethanesulfonamide
PubChem CID63933892
Molecular FormulaC7H17NO3S
Molecular Weight195.28 g/mol
Exact Mass195.09
IUPAC NameN-(2-ethoxyethyl)-N-ethylmethanesulfonamide
SMILESCCOCCN(CC)S(C)(=O)=O
InChIInChI=1S/C7H17NO3S/c1-4-8(12(3,9)10)6-7-11-5-2/h4-7H2,1-3H3
InChIKeyFWQNJGRTRHHNEM-UHFFFAOYSA-N
XLogP0.30
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.28
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-ethoxyethyl)-N-ethylmethanesulfonamide?
The IUPAC name of N-(2-ethoxyethyl)-N-ethylmethanesulfonamide (CID 63933892) is N-(2-ethoxyethyl)-N-ethylmethanesulfonamide.
What is the SMILES notation for N-(2-ethoxyethyl)-N-ethylmethanesulfonamide?
The canonical SMILES for N-(2-ethoxyethyl)-N-ethylmethanesulfonamide is CCOCCN(CC)S(C)(=O)=O.
What is the InChIKey of N-(2-ethoxyethyl)-N-ethylmethanesulfonamide?
The InChIKey is FWQNJGRTRHHNEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO3S/c1-4-8(12(3,9)10)6-7-11-5-2/h4-7H2,1-3H3.
What are the key properties of N-(2-ethoxyethyl)-N-ethylmethanesulfonamide?
N-(2-ethoxyethyl)-N-ethylmethanesulfonamide has a molecular weight of 195.28 g/mol, XLogP of 0.30, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N-ethylmethanesulfonamide is sourced from PubChem (CID 63933892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).