magnesium bis(N,N-dimethyl-1-phenylmethanamine)

C18H24MgN2 — CID 15763637

IUPACmagnesium bis(N,N-dimethyl-1-phenylmethanamine)
SMILESCN(C)Cc1[c-]cccc1.CN(C)Cc1[c-]cccc1.[Mg+2]
InChIInChI=1S/2C9H12N.Mg/c2*1-10(2)8-9-6-4-3-5-7-9;/h2*3-6H,8H2,1-2H3;/q2*-1;+2
InChIKeyVYEIFPVVVSMDJD-UHFFFAOYSA-N
MW292.71 g/mol
LogP2.72
Rot. Bonds4

About magnesium bis(N,N-dimethyl-1-phenylmethanamine)

magnesium bis(N,N-dimethyl-1-phenylmethanamine) (PubChem CID 15763637) has the molecular formula C18H24MgN2 and a molecular weight of 292.71 g/mol. Its IUPAC name is magnesium bis(N,N-dimethyl-1-phenylmethanamine).

Molecular Properties

Compound Namemagnesium bis(N,N-dimethyl-1-phenylmethanamine)
PubChem CID15763637
Molecular FormulaC18H24MgN2
Molecular Weight292.71 g/mol
Exact Mass292.18
IUPAC Namemagnesium bis(N,N-dimethyl-1-phenylmethanamine)
SMILESCN(C)Cc1[c-]cccc1.CN(C)Cc1[c-]cccc1.[Mg+2]
InChIInChI=1S/2C9H12N.Mg/c2*1-10(2)8-9-6-4-3-5-7-9;/h2*3-6H,8H2,1-2H3;/q2*-1;+2
InChIKeyVYEIFPVVVSMDJD-UHFFFAOYSA-N
XLogP2.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.71
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 bis(N,N-dimethyl-1-phenylmethanamine)?
The IUPAC name of magnesium bis(N,N-dimethyl-1-phenylmethanamine) (CID 15763637) is magnesium bis(N,N-dimethyl-1-phenylmethanamine).
What is the SMILES notation for magnesium bis(N,N-dimethyl-1-phenylmethanamine)?
The canonical SMILES for magnesium bis(N,N-dimethyl-1-phenylmethanamine) is CN(C)Cc1[c-]cccc1.CN(C)Cc1[c-]cccc1.[Mg+2].
What is the InChIKey of magnesium bis(N,N-dimethyl-1-phenylmethanamine)?
The InChIKey is VYEIFPVVVSMDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H12N.Mg/c2*1-10(2)8-9-6-4-3-5-7-9;/h2*3-6H,8H2,1-2H3;/q2*-1;+2.
What are the key properties of magnesium bis(N,N-dimethyl-1-phenylmethanamine)?
magnesium bis(N,N-dimethyl-1-phenylmethanamine) has a molecular weight of 292.71 g/mol, XLogP of 2.72, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium bis(N,N-dimethyl-1-phenylmethanamine) is sourced from PubChem (CID 15763637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).