1-ethyl-1-(methoxysulfinylamino)cyclobutane

C7H15NO2S — CID 148598294

IUPAC1-ethyl-1-(methoxysulfinylamino)cyclobutane
SMILESCCC1(NS(=O)OC)CCC1
InChIInChI=1S/C7H15NO2S/c1-3-7(5-4-6-7)8-11(9)10-2/h8H,3-6H2,1-2H3
InChIKeyNBZVPCCHEONKFK-UHFFFAOYSA-N
MW177.27 g/mol
LogP1.13
Rot. Bonds4

About 1-ethyl-1-(methoxysulfinylamino)cyclobutane

1-ethyl-1-(methoxysulfinylamino)cyclobutane (PubChem CID 148598294) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is 1-ethyl-1-(methoxysulfinylamino)cyclobutane.

Molecular Properties

Compound Name1-ethyl-1-(methoxysulfinylamino)cyclobutane
PubChem CID148598294
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC Name1-ethyl-1-(methoxysulfinylamino)cyclobutane
SMILESCCC1(NS(=O)OC)CCC1
InChIInChI=1S/C7H15NO2S/c1-3-7(5-4-6-7)8-11(9)10-2/h8H,3-6H2,1-2H3
InChIKeyNBZVPCCHEONKFK-UHFFFAOYSA-N
XLogP1.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Ethyl-1-(sulfinoamino)cyclobutane
CID 89159662
1-Methyl-1-(sulfinatoamino)cyclobutane
CID 156557764
N-(1-ethylcyclobutyl)sulfamoyl chloride
CID 114958469
1-Ethyl-1-(sulfamoylamino)cyclobutane
CID 115673011

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-(methoxysulfinylamino)cyclobutane?
The IUPAC name of 1-ethyl-1-(methoxysulfinylamino)cyclobutane (CID 148598294) is 1-ethyl-1-(methoxysulfinylamino)cyclobutane.
What is the SMILES notation for 1-ethyl-1-(methoxysulfinylamino)cyclobutane?
The canonical SMILES for 1-ethyl-1-(methoxysulfinylamino)cyclobutane is CCC1(NS(=O)OC)CCC1.
What is the InChIKey of 1-ethyl-1-(methoxysulfinylamino)cyclobutane?
The InChIKey is NBZVPCCHEONKFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-3-7(5-4-6-7)8-11(9)10-2/h8H,3-6H2,1-2H3.
What are the key properties of 1-ethyl-1-(methoxysulfinylamino)cyclobutane?
1-ethyl-1-(methoxysulfinylamino)cyclobutane has a molecular weight of 177.27 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(methoxysulfinylamino)cyclobutane is sourced from PubChem (CID 148598294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).