N,N-diethylethenesulfonamide

C6H13NO2S — CID 15914519

IUPACN,N-diethylethenesulfonamide
SMILESC=CS(=O)(=O)N(CC)CC
InChIInChI=1S/C6H13NO2S/c1-4-7(5-2)10(8,9)6-3/h6H,3-5H2,1-2H3
InChIKeyAQJYJFZSNMNVLN-UHFFFAOYSA-N
MW163.24 g/mol
LogP0.80
Rot. Bonds4

About N,N-diethylethenesulfonamide

N,N-diethylethenesulfonamide (PubChem CID 15914519) has the molecular formula C6H13NO2S and a molecular weight of 163.24 g/mol. Its IUPAC name is N,N-diethylethenesulfonamide.

Molecular Properties

Compound NameN,N-diethylethenesulfonamide
PubChem CID15914519
Molecular FormulaC6H13NO2S
Molecular Weight163.24 g/mol
Exact Mass163.07
IUPAC NameN,N-diethylethenesulfonamide
SMILESC=CS(=O)(=O)N(CC)CC
InChIInChI=1S/C6H13NO2S/c1-4-7(5-2)10(8,9)6-3/h6H,3-5H2,1-2H3
InChIKeyAQJYJFZSNMNVLN-UHFFFAOYSA-N
XLogP0.80
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylethenesulfonamide?
The IUPAC name of N,N-diethylethenesulfonamide (CID 15914519) is N,N-diethylethenesulfonamide.
What is the SMILES notation for N,N-diethylethenesulfonamide?
The canonical SMILES for N,N-diethylethenesulfonamide is C=CS(=O)(=O)N(CC)CC.
What is the InChIKey of N,N-diethylethenesulfonamide?
The InChIKey is AQJYJFZSNMNVLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2S/c1-4-7(5-2)10(8,9)6-3/h6H,3-5H2,1-2H3.
What are the key properties of N,N-diethylethenesulfonamide?
N,N-diethylethenesulfonamide has a molecular weight of 163.24 g/mol, XLogP of 0.80, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethenesulfonamide is sourced from PubChem (CID 15914519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).