copper;1,3-oxazolidine;sulfane

C3H9CuNOS — CID 157472019

IUPACcopper;1,3-oxazolidine;sulfane
SMILESC1COCN1.S.[Cu]
InChIInChI=1S/C3H7NO.Cu.H2S/c1-2-5-3-4-1;;/h4H,1-3H2;;1H2
InChIKeyWJEJOXVUJJBHGO-UHFFFAOYSA-N
MW170.72 g/mol
LogP-0.33
Rot. Bonds

About copper;1,3-oxazolidine;sulfane

copper;1,3-oxazolidine;sulfane (PubChem CID 157472019) has the molecular formula C3H9CuNOS and a molecular weight of 170.72 g/mol. Its IUPAC name is copper;1,3-oxazolidine;sulfane.

Molecular Properties

Compound Namecopper;1,3-oxazolidine;sulfane
PubChem CID157472019
Molecular FormulaC3H9CuNOS
Molecular Weight170.72 g/mol
Exact Mass169.97
IUPAC Namecopper;1,3-oxazolidine;sulfane
SMILESC1COCN1.S.[Cu]
InChIInChI=1S/C3H7NO.Cu.H2S/c1-2-5-3-4-1;;/h4H,1-3H2;;1H2
InChIKeyWJEJOXVUJJBHGO-UHFFFAOYSA-N
XLogP-0.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.72
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of copper;1,3-oxazolidine;sulfane?
The IUPAC name of copper;1,3-oxazolidine;sulfane (CID 157472019) is copper;1,3-oxazolidine;sulfane.
What is the SMILES notation for copper;1,3-oxazolidine;sulfane?
The canonical SMILES for copper;1,3-oxazolidine;sulfane is C1COCN1.S.[Cu].
What is the InChIKey of copper;1,3-oxazolidine;sulfane?
The InChIKey is WJEJOXVUJJBHGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.Cu.H2S/c1-2-5-3-4-1;;/h4H,1-3H2;;1H2.
What are the key properties of copper;1,3-oxazolidine;sulfane?
copper;1,3-oxazolidine;sulfane has a molecular weight of 170.72 g/mol, XLogP of -0.33, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;1,3-oxazolidine;sulfane is sourced from PubChem (CID 157472019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).