N-ethyl-2-methoxy-N-propylethanesulfonamide

C8H19NO3S — CID 123769076

IUPACN-ethyl-2-methoxy-N-propylethanesulfonamide
SMILESCCCN(CC)S(=O)(=O)CCOC
InChIInChI=1S/C8H19NO3S/c1-4-6-9(5-2)13(10,11)8-7-12-3/h4-8H2,1-3H3
InChIKeyOQFRVPHEFPJXFZ-UHFFFAOYSA-N
MW209.31 g/mol
LogP0.69
Rot. Bonds7

About N-ethyl-2-methoxy-N-propylethanesulfonamide

N-ethyl-2-methoxy-N-propylethanesulfonamide (PubChem CID 123769076) has the molecular formula C8H19NO3S and a molecular weight of 209.31 g/mol. Its IUPAC name is N-ethyl-2-methoxy-N-propylethanesulfonamide.

Molecular Properties

Compound NameN-ethyl-2-methoxy-N-propylethanesulfonamide
PubChem CID123769076
Molecular FormulaC8H19NO3S
Molecular Weight209.31 g/mol
Exact Mass209.11
IUPAC NameN-ethyl-2-methoxy-N-propylethanesulfonamide
SMILESCCCN(CC)S(=O)(=O)CCOC
InChIInChI=1S/C8H19NO3S/c1-4-6-9(5-2)13(10,11)8-7-12-3/h4-8H2,1-3H3
InChIKeyOQFRVPHEFPJXFZ-UHFFFAOYSA-N
XLogP0.69
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-N-propylethanesulfonamide?
The IUPAC name of N-ethyl-2-methoxy-N-propylethanesulfonamide (CID 123769076) is N-ethyl-2-methoxy-N-propylethanesulfonamide.
What is the SMILES notation for N-ethyl-2-methoxy-N-propylethanesulfonamide?
The canonical SMILES for N-ethyl-2-methoxy-N-propylethanesulfonamide is CCCN(CC)S(=O)(=O)CCOC.
What is the InChIKey of N-ethyl-2-methoxy-N-propylethanesulfonamide?
The InChIKey is OQFRVPHEFPJXFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO3S/c1-4-6-9(5-2)13(10,11)8-7-12-3/h4-8H2,1-3H3.
What are the key properties of N-ethyl-2-methoxy-N-propylethanesulfonamide?
N-ethyl-2-methoxy-N-propylethanesulfonamide has a molecular weight of 209.31 g/mol, XLogP of 0.69, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-N-propylethanesulfonamide is sourced from PubChem (CID 123769076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).