carbanide;1,3-oxazolidine;palladium(2+);dibromide

C5H13Br2NOPd-2 — CID 173179223

IUPACcarbanide;1,3-oxazolidine;palladium(2+);dibromide
SMILESC1COCN1.[Br-].[Br-].[CH3-].[CH3-].[Pd+2]
InChIInChI=1S/C3H7NO.2CH3.2BrH.Pd/c1-2-5-3-4-1;;;;;/h4H,1-3H2;2*1H3;2*1H;/q;2*-1;;;+2/p-2
InChIKeyCOQCFQWXEYXPMA-UHFFFAOYSA-L
MW369.39 g/mol
LogP-5.53
Rot. Bonds

About carbanide;1,3-oxazolidine;palladium(2+);dibromide

carbanide;1,3-oxazolidine;palladium(2+);dibromide (PubChem CID 173179223) has the molecular formula C5H13Br2NOPd-2 and a molecular weight of 369.39 g/mol. Its IUPAC name is carbanide;1,3-oxazolidine;palladium(2+);dibromide.

Molecular Properties

Compound Namecarbanide;1,3-oxazolidine;palladium(2+);dibromide
PubChem CID173179223
Molecular FormulaC5H13Br2NOPd-2
Molecular Weight369.39 g/mol
Exact Mass366.84
IUPAC Namecarbanide;1,3-oxazolidine;palladium(2+);dibromide
SMILESC1COCN1.[Br-].[Br-].[CH3-].[CH3-].[Pd+2]
InChIInChI=1S/C3H7NO.2CH3.2BrH.Pd/c1-2-5-3-4-1;;;;;/h4H,1-3H2;2*1H3;2*1H;/q;2*-1;;;+2/p-2
InChIKeyCOQCFQWXEYXPMA-UHFFFAOYSA-L
XLogP-5.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.39
LogP ≤ 5-5.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

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CID 87713044
CID 87713044
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1,4,7,10-tetraoxa-13,16,19-triazacyclohenicosane
CID 10063702
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Frequently Asked Questions

What is the IUPAC name of carbanide;1,3-oxazolidine;palladium(2+);dibromide?
The IUPAC name of carbanide;1,3-oxazolidine;palladium(2+);dibromide (CID 173179223) is carbanide;1,3-oxazolidine;palladium(2+);dibromide.
What is the SMILES notation for carbanide;1,3-oxazolidine;palladium(2+);dibromide?
The canonical SMILES for carbanide;1,3-oxazolidine;palladium(2+);dibromide is C1COCN1.[Br-].[Br-].[CH3-].[CH3-].[Pd+2].
What is the InChIKey of carbanide;1,3-oxazolidine;palladium(2+);dibromide?
The InChIKey is COQCFQWXEYXPMA-UHFFFAOYSA-L. The full InChI is InChI=1S/C3H7NO.2CH3.2BrH.Pd/c1-2-5-3-4-1;;;;;/h4H,1-3H2;2*1H3;2*1H;/q;2*-1;;;+2/p-2.
What are the key properties of carbanide;1,3-oxazolidine;palladium(2+);dibromide?
carbanide;1,3-oxazolidine;palladium(2+);dibromide has a molecular weight of 369.39 g/mol, XLogP of -5.53, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;1,3-oxazolidine;palladium(2+);dibromide is sourced from PubChem (CID 173179223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).