magnesium;carbanide;N-methanidyl-N-methylmethanamine

C4H11MgN — CID 11159292

IUPACmagnesium;carbanide;N-methanidyl-N-methylmethanamine
SMILES[CH2-]N(C)C.[CH3-].[Mg+2]
InChIInChI=1S/C3H8N.CH3.Mg/c1-4(2)3;;/h1H2,2-3H3;1H3;/q2*-1;+2
InChIKeyLOTSYLMBSDQZIO-UHFFFAOYSA-N
MW97.44 g/mol
LogP0.41
Rot. Bonds

About magnesium;carbanide;N-methanidyl-N-methylmethanamine

magnesium;carbanide;N-methanidyl-N-methylmethanamine (PubChem CID 11159292) has the molecular formula C4H11MgN and a molecular weight of 97.44 g/mol. Its IUPAC name is magnesium;carbanide;N-methanidyl-N-methylmethanamine.

Molecular Properties

Compound Namemagnesium;carbanide;N-methanidyl-N-methylmethanamine
PubChem CID11159292
Molecular FormulaC4H11MgN
Molecular Weight97.44 g/mol
Exact Mass97.07
IUPAC Namemagnesium;carbanide;N-methanidyl-N-methylmethanamine
SMILES[CH2-]N(C)C.[CH3-].[Mg+2]
InChIInChI=1S/C3H8N.CH3.Mg/c1-4(2)3;;/h1H2,2-3H3;1H3;/q2*-1;+2
InChIKeyLOTSYLMBSDQZIO-UHFFFAOYSA-N
XLogP0.41
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.44
LogP ≤ 50.41
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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Frequently Asked Questions

What is the IUPAC name of magnesium;carbanide;N-methanidyl-N-methylmethanamine?
The IUPAC name of magnesium;carbanide;N-methanidyl-N-methylmethanamine (CID 11159292) is magnesium;carbanide;N-methanidyl-N-methylmethanamine.
What is the SMILES notation for magnesium;carbanide;N-methanidyl-N-methylmethanamine?
The canonical SMILES for magnesium;carbanide;N-methanidyl-N-methylmethanamine is [CH2-]N(C)C.[CH3-].[Mg+2].
What is the InChIKey of magnesium;carbanide;N-methanidyl-N-methylmethanamine?
The InChIKey is LOTSYLMBSDQZIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N.CH3.Mg/c1-4(2)3;;/h1H2,2-3H3;1H3;/q2*-1;+2.
What are the key properties of magnesium;carbanide;N-methanidyl-N-methylmethanamine?
magnesium;carbanide;N-methanidyl-N-methylmethanamine has a molecular weight of 97.44 g/mol, XLogP of 0.41, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;carbanide;N-methanidyl-N-methylmethanamine is sourced from PubChem (CID 11159292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).