4,5-dihydro-1,3-oxazole;manganese

C3H5MnNO — CID 160543955

IUPAC4,5-dihydro-1,3-oxazole;manganese
SMILESC1=NCCO1.[Mn]
InChIInChI=1S/C3H5NO.Mn/c1-2-5-3-4-1;/h3H,1-2H2;
InChIKeyQXECPDBHLMPQQK-UHFFFAOYSA-N
MW126.02 g/mol
LogP0.04
Rot. Bonds

About 4,5-dihydro-1,3-oxazole;manganese

4,5-dihydro-1,3-oxazole;manganese (PubChem CID 160543955) has the molecular formula C3H5MnNO and a molecular weight of 126.02 g/mol. Its IUPAC name is 4,5-dihydro-1,3-oxazole;manganese.

Molecular Properties

Compound Name4,5-dihydro-1,3-oxazole;manganese
PubChem CID160543955
Molecular FormulaC3H5MnNO
Molecular Weight126.02 g/mol
Exact Mass125.98
IUPAC Name4,5-dihydro-1,3-oxazole;manganese
SMILESC1=NCCO1.[Mn]
InChIInChI=1S/C3H5NO.Mn/c1-2-5-3-4-1;/h3H,1-2H2;
InChIKeyQXECPDBHLMPQQK-UHFFFAOYSA-N
XLogP0.04
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.02
LogP ≤ 50.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1,3-oxazole;manganese?
The IUPAC name of 4,5-dihydro-1,3-oxazole;manganese (CID 160543955) is 4,5-dihydro-1,3-oxazole;manganese.
What is the SMILES notation for 4,5-dihydro-1,3-oxazole;manganese?
The canonical SMILES for 4,5-dihydro-1,3-oxazole;manganese is C1=NCCO1.[Mn].
What is the InChIKey of 4,5-dihydro-1,3-oxazole;manganese?
The InChIKey is QXECPDBHLMPQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NO.Mn/c1-2-5-3-4-1;/h3H,1-2H2;.
What are the key properties of 4,5-dihydro-1,3-oxazole;manganese?
4,5-dihydro-1,3-oxazole;manganese has a molecular weight of 126.02 g/mol, XLogP of 0.04, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1,3-oxazole;manganese is sourced from PubChem (CID 160543955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).