copper bis(4,5-dihydro-1,3-oxazole)

C6H10CuN2O2+2 — CID 18436662

IUPACcopper bis(4,5-dihydro-1,3-oxazole)
SMILESC1=NCCO1.C1=NCCO1.[Cu+2]
InChIInChI=1S/2C3H5NO.Cu/c2*1-2-5-3-4-1;/h2*3H,1-2H2;/q;;+2
InChIKeyKKADLUDSYOVXKI-UHFFFAOYSA-N
MW205.70 g/mol
LogP0.09
Rot. Bonds

About copper bis(4,5-dihydro-1,3-oxazole)

copper bis(4,5-dihydro-1,3-oxazole) (PubChem CID 18436662) has the molecular formula C6H10CuN2O2+2 and a molecular weight of 205.70 g/mol. Its IUPAC name is copper bis(4,5-dihydro-1,3-oxazole).

Molecular Properties

Compound Namecopper bis(4,5-dihydro-1,3-oxazole)
PubChem CID18436662
Molecular FormulaC6H10CuN2O2+2
Molecular Weight205.70 g/mol
Exact Mass205.00
IUPAC Namecopper bis(4,5-dihydro-1,3-oxazole)
SMILESC1=NCCO1.C1=NCCO1.[Cu+2]
InChIInChI=1S/2C3H5NO.Cu/c2*1-2-5-3-4-1;/h2*3H,1-2H2;/q;;+2
InChIKeyKKADLUDSYOVXKI-UHFFFAOYSA-N
XLogP0.09
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.70
LogP ≤ 50.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of copper bis(4,5-dihydro-1,3-oxazole)?
The IUPAC name of copper bis(4,5-dihydro-1,3-oxazole) (CID 18436662) is copper bis(4,5-dihydro-1,3-oxazole).
What is the SMILES notation for copper bis(4,5-dihydro-1,3-oxazole)?
The canonical SMILES for copper bis(4,5-dihydro-1,3-oxazole) is C1=NCCO1.C1=NCCO1.[Cu+2].
What is the InChIKey of copper bis(4,5-dihydro-1,3-oxazole)?
The InChIKey is KKADLUDSYOVXKI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H5NO.Cu/c2*1-2-5-3-4-1;/h2*3H,1-2H2;/q;;+2.
What are the key properties of copper bis(4,5-dihydro-1,3-oxazole)?
copper bis(4,5-dihydro-1,3-oxazole) has a molecular weight of 205.70 g/mol, XLogP of 0.09, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis(4,5-dihydro-1,3-oxazole) is sourced from PubChem (CID 18436662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).