ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite

C8H16FNO2S — CID 142573287

IUPACethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite
SMILESCC.COC1CC(SF)C(=O)N1C
InChIInChI=1S/C6H10FNO2S.C2H6/c1-8-5(10-2)3-4(11-7)6(8)9;1-2/h4-5H,3H2,1-2H3;1-2H3
InChIKeyRHJVFAJTYPDXLS-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.83
Rot. Bonds2

About ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite

ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite (PubChem CID 142573287) has the molecular formula C8H16FNO2S and a molecular weight of 209.29 g/mol. Its IUPAC name is ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite.

Molecular Properties

Compound Nameethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite
PubChem CID142573287
Molecular FormulaC8H16FNO2S
Molecular Weight209.29 g/mol
Exact Mass209.09
IUPAC Nameethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite
SMILESCC.COC1CC(SF)C(=O)N1C
InChIInChI=1S/C6H10FNO2S.C2H6/c1-8-5(10-2)3-4(11-7)6(8)9;1-2/h4-5H,3H2,1-2H3;1-2H3
InChIKeyRHJVFAJTYPDXLS-UHFFFAOYSA-N
XLogP1.83
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite?
The IUPAC name of ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite (CID 142573287) is ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite.
What is the SMILES notation for ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite?
The canonical SMILES for ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite is CC.COC1CC(SF)C(=O)N1C.
What is the InChIKey of ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite?
The InChIKey is RHJVFAJTYPDXLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FNO2S.C2H6/c1-8-5(10-2)3-4(11-7)6(8)9;1-2/h4-5H,3H2,1-2H3;1-2H3.
What are the key properties of ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite?
ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite has a molecular weight of 209.29 g/mol, XLogP of 1.83, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(5-methoxy-1-methyl-2-oxopyrrolidin-3-yl) thiohypofluorite is sourced from PubChem (CID 142573287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).