magnesium;piperidine;bromide

C5H11BrMgN+ — CID 173330066

IUPACmagnesium;piperidine;bromide
SMILESC1CCNCC1.[Br-].[Mg+2]
InChIInChI=1S/C5H11N.BrH.Mg/c1-2-4-6-5-3-1;;/h6H,1-5H2;1H;/q;;+2/p-1
InChIKeyGTQYZZFYYDJHDX-UHFFFAOYSA-M
MW189.36 g/mol
LogP-2.62
Rot. Bonds

About magnesium;piperidine;bromide

magnesium;piperidine;bromide (PubChem CID 173330066) has the molecular formula C5H11BrMgN+ and a molecular weight of 189.36 g/mol. Its IUPAC name is magnesium;piperidine;bromide.

Molecular Properties

Compound Namemagnesium;piperidine;bromide
PubChem CID173330066
Molecular FormulaC5H11BrMgN+
Molecular Weight189.36 g/mol
Exact Mass187.99
IUPAC Namemagnesium;piperidine;bromide
SMILESC1CCNCC1.[Br-].[Mg+2]
InChIInChI=1S/C5H11N.BrH.Mg/c1-2-4-6-5-3-1;;/h6H,1-5H2;1H;/q;;+2/p-1
InChIKeyGTQYZZFYYDJHDX-UHFFFAOYSA-M
XLogP-2.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.36
LogP ≤ 5-2.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

hydron;piperidine;bromide
CID 21435933
azacycloheptadecane
CID 22627811
azepane;piperidine
CID 67415778
1,12,23,34-tetrazacyclotetratetracontane
CID 15722582
1,6,13-triazacyclononadecane
CID 71376561
1,8,15,22-tetrazacyclooctacosane
CID 15722579
azacyclotriacontane
CID 57238597
azonane;manganese
CID 57468151
1,4,11,14-tetrazacycloicosane
CID 10989751
λ2-plumbane;piperidine
CID 174691301
bis(piperidine);hydrate;tetrahydrochloride
CID 67752585
lithium;azacycloundecane;hydride
CID 175005284

Frequently Asked Questions

What is the IUPAC name of magnesium;piperidine;bromide?
The IUPAC name of magnesium;piperidine;bromide (CID 173330066) is magnesium;piperidine;bromide.
What is the SMILES notation for magnesium;piperidine;bromide?
The canonical SMILES for magnesium;piperidine;bromide is C1CCNCC1.[Br-].[Mg+2].
What is the InChIKey of magnesium;piperidine;bromide?
The InChIKey is GTQYZZFYYDJHDX-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H11N.BrH.Mg/c1-2-4-6-5-3-1;;/h6H,1-5H2;1H;/q;;+2/p-1.
What are the key properties of magnesium;piperidine;bromide?
magnesium;piperidine;bromide has a molecular weight of 189.36 g/mol, XLogP of -2.62, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;piperidine;bromide is sourced from PubChem (CID 173330066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).