4-[1-(sulfamoylamino)ethyl]oxane

C7H16N2O3S — CID 103768185

IUPAC4-[1-(sulfamoylamino)ethyl]oxane
SMILESCC(NS(N)(=O)=O)C1CCOCC1
InChIInChI=1S/C7H16N2O3S/c1-6(9-13(8,10)11)7-2-4-12-5-3-7/h6-7,9H,2-5H2,1H3,(H2,8,10,11)
InChIKeyXLVVJRHLUDNVLK-UHFFFAOYSA-N
MW208.28 g/mol
LogP-0.41
Rot. Bonds3

About 4-[1-(sulfamoylamino)ethyl]oxane

4-[1-(sulfamoylamino)ethyl]oxane (PubChem CID 103768185) has the molecular formula C7H16N2O3S and a molecular weight of 208.28 g/mol. Its IUPAC name is 4-[1-(sulfamoylamino)ethyl]oxane.

Molecular Properties

Compound Name4-[1-(sulfamoylamino)ethyl]oxane
PubChem CID103768185
Molecular FormulaC7H16N2O3S
Molecular Weight208.28 g/mol
Exact Mass208.09
IUPAC Name4-[1-(sulfamoylamino)ethyl]oxane
SMILESCC(NS(N)(=O)=O)C1CCOCC1
InChIInChI=1S/C7H16N2O3S/c1-6(9-13(8,10)11)7-2-4-12-5-3-7/h6-7,9H,2-5H2,1H3,(H2,8,10,11)
InChIKeyXLVVJRHLUDNVLK-UHFFFAOYSA-N
XLogP-0.41
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(sulfamoylamino)ethyl]oxane?
The IUPAC name of 4-[1-(sulfamoylamino)ethyl]oxane (CID 103768185) is 4-[1-(sulfamoylamino)ethyl]oxane.
What is the SMILES notation for 4-[1-(sulfamoylamino)ethyl]oxane?
The canonical SMILES for 4-[1-(sulfamoylamino)ethyl]oxane is CC(NS(N)(=O)=O)C1CCOCC1.
What is the InChIKey of 4-[1-(sulfamoylamino)ethyl]oxane?
The InChIKey is XLVVJRHLUDNVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3S/c1-6(9-13(8,10)11)7-2-4-12-5-3-7/h6-7,9H,2-5H2,1H3,(H2,8,10,11).
What are the key properties of 4-[1-(sulfamoylamino)ethyl]oxane?
4-[1-(sulfamoylamino)ethyl]oxane has a molecular weight of 208.28 g/mol, XLogP of -0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(sulfamoylamino)ethyl]oxane is sourced from PubChem (CID 103768185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).