magnesium;N,N-dimethylpropan-1-amine;bromide

C5H12BrMgN — CID 11275524

IUPACmagnesium;N,N-dimethylpropan-1-amine;bromide
SMILES[Br-].[CH2-]CCN(C)C.[Mg+2]
InChIInChI=1S/C5H12N.BrH.Mg/c1-4-5-6(2)3;;/h1,4-5H2,2-3H3;1H;/q-1;;+2/p-1
InChIKeyHDLZEDUNPCLAMB-UHFFFAOYSA-M
MW190.37 g/mol
LogP-2.60
Rot. Bonds2

About magnesium;N,N-dimethylpropan-1-amine;bromide

magnesium;N,N-dimethylpropan-1-amine;bromide (PubChem CID 11275524) has the molecular formula C5H12BrMgN and a molecular weight of 190.37 g/mol. Its IUPAC name is magnesium;N,N-dimethylpropan-1-amine;bromide.

Molecular Properties

Compound Namemagnesium;N,N-dimethylpropan-1-amine;bromide
PubChem CID11275524
Molecular FormulaC5H12BrMgN
Molecular Weight190.37 g/mol
Exact Mass189.00
IUPAC Namemagnesium;N,N-dimethylpropan-1-amine;bromide
SMILES[Br-].[CH2-]CCN(C)C.[Mg+2]
InChIInChI=1S/C5H12N.BrH.Mg/c1-4-5-6(2)3;;/h1,4-5H2,2-3H3;1H;/q-1;;+2/p-1
InChIKeyHDLZEDUNPCLAMB-UHFFFAOYSA-M
XLogP-2.60
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.37
LogP ≤ 5-2.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of magnesium;N,N-dimethylpropan-1-amine;bromide?
The IUPAC name of magnesium;N,N-dimethylpropan-1-amine;bromide (CID 11275524) is magnesium;N,N-dimethylpropan-1-amine;bromide.
What is the SMILES notation for magnesium;N,N-dimethylpropan-1-amine;bromide?
The canonical SMILES for magnesium;N,N-dimethylpropan-1-amine;bromide is [Br-].[CH2-]CCN(C)C.[Mg+2].
What is the InChIKey of magnesium;N,N-dimethylpropan-1-amine;bromide?
The InChIKey is HDLZEDUNPCLAMB-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H12N.BrH.Mg/c1-4-5-6(2)3;;/h1,4-5H2,2-3H3;1H;/q-1;;+2/p-1.
What are the key properties of magnesium;N,N-dimethylpropan-1-amine;bromide?
magnesium;N,N-dimethylpropan-1-amine;bromide has a molecular weight of 190.37 g/mol, XLogP of -2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;N,N-dimethylpropan-1-amine;bromide is sourced from PubChem (CID 11275524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).