2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane

C7H16N2O3S — CID 103743710

IUPAC2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane
SMILESCOC1CC(NS(N)(=O)=O)C1(C)C
InChIInChI=1S/C7H16N2O3S/c1-7(2)5(4-6(7)12-3)9-13(8,10)11/h5-6,9H,4H2,1-3H3,(H2,8,10,11)
InChIKeyGLPPAUPYOBRFCE-UHFFFAOYSA-N
MW208.28 g/mol
LogP-0.41
Rot. Bonds3

About 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane

2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane (PubChem CID 103743710) has the molecular formula C7H16N2O3S and a molecular weight of 208.28 g/mol. Its IUPAC name is 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane.

Molecular Properties

Compound Name2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane
PubChem CID103743710
Molecular FormulaC7H16N2O3S
Molecular Weight208.28 g/mol
Exact Mass208.09
IUPAC Name2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane
SMILESCOC1CC(NS(N)(=O)=O)C1(C)C
InChIInChI=1S/C7H16N2O3S/c1-7(2)5(4-6(7)12-3)9-13(8,10)11/h5-6,9H,4H2,1-3H3,(H2,8,10,11)
InChIKeyGLPPAUPYOBRFCE-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 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane?
The IUPAC name of 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane (CID 103743710) is 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane.
What is the SMILES notation for 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane?
The canonical SMILES for 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane is COC1CC(NS(N)(=O)=O)C1(C)C.
What is the InChIKey of 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane?
The InChIKey is GLPPAUPYOBRFCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3S/c1-7(2)5(4-6(7)12-3)9-13(8,10)11/h5-6,9H,4H2,1-3H3,(H2,8,10,11).
What are the key properties of 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane?
2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane 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 2-methoxy-1,1-dimethyl-4-(sulfamoylamino)cyclobutane is sourced from PubChem (CID 103743710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).