N-ethyl-N-propylmethanesulfonamide

C6H15NO2S — CID 62049896

IUPACN-ethyl-N-propylmethanesulfonamide
SMILESCCCN(CC)S(C)(=O)=O
InChIInChI=1S/C6H15NO2S/c1-4-6-7(5-2)10(3,8)9/h4-6H2,1-3H3
InChIKeyQLFWVEHQNOBTCP-UHFFFAOYSA-N
MW165.26 g/mol
LogP0.68
Rot. Bonds4

About N-ethyl-N-propylmethanesulfonamide

N-ethyl-N-propylmethanesulfonamide (PubChem CID 62049896) has the molecular formula C6H15NO2S and a molecular weight of 165.26 g/mol. Its IUPAC name is N-ethyl-N-propylmethanesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-propylmethanesulfonamide
PubChem CID62049896
Molecular FormulaC6H15NO2S
Molecular Weight165.26 g/mol
Exact Mass165.08
IUPAC NameN-ethyl-N-propylmethanesulfonamide
SMILESCCCN(CC)S(C)(=O)=O
InChIInChI=1S/C6H15NO2S/c1-4-6-7(5-2)10(3,8)9/h4-6H2,1-3H3
InChIKeyQLFWVEHQNOBTCP-UHFFFAOYSA-N
XLogP0.68
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.26
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propylmethanesulfonamide?
The IUPAC name of N-ethyl-N-propylmethanesulfonamide (CID 62049896) is N-ethyl-N-propylmethanesulfonamide.
What is the SMILES notation for N-ethyl-N-propylmethanesulfonamide?
The canonical SMILES for N-ethyl-N-propylmethanesulfonamide is CCCN(CC)S(C)(=O)=O.
What is the InChIKey of N-ethyl-N-propylmethanesulfonamide?
The InChIKey is QLFWVEHQNOBTCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2S/c1-4-6-7(5-2)10(3,8)9/h4-6H2,1-3H3.
What are the key properties of N-ethyl-N-propylmethanesulfonamide?
N-ethyl-N-propylmethanesulfonamide has a molecular weight of 165.26 g/mol, XLogP of 0.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propylmethanesulfonamide is sourced from PubChem (CID 62049896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).