magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide

C17H22MgN2Si — CID 11232045

IUPACmagnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide
SMILES[CH2-][Si](C)(C)N(Cc1ccccc1)[N-]Cc1ccccc1.[Mg+2]
InChIInChI=1S/C17H22N2Si.Mg/c1-20(2,3)19(15-17-12-8-5-9-13-17)18-14-16-10-6-4-7-11-16;/h4-13H,1,14-15H2,2-3H3;/q-2;+2
InChIKeyPBKMUWOCWLFGAZ-UHFFFAOYSA-N
MW306.77 g/mol
LogP4.18
Rot. Bonds6

About magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide

magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide (PubChem CID 11232045) has the molecular formula C17H22MgN2Si and a molecular weight of 306.77 g/mol. Its IUPAC name is magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide.

Molecular Properties

Compound Namemagnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide
PubChem CID11232045
Molecular FormulaC17H22MgN2Si
Molecular Weight306.77 g/mol
Exact Mass306.14
IUPAC Namemagnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide
SMILES[CH2-][Si](C)(C)N(Cc1ccccc1)[N-]Cc1ccccc1.[Mg+2]
InChIInChI=1S/C17H22N2Si.Mg/c1-20(2,3)19(15-17-12-8-5-9-13-17)18-14-16-10-6-4-7-11-16;/h4-13H,1,14-15H2,2-3H3;/q-2;+2
InChIKeyPBKMUWOCWLFGAZ-UHFFFAOYSA-N
XLogP4.18
TPSA17.34 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide?
The IUPAC name of magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide (CID 11232045) is magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide.
What is the SMILES notation for magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide?
The canonical SMILES for magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide is [CH2-][Si](C)(C)N(Cc1ccccc1)[N-]Cc1ccccc1.[Mg+2].
What is the InChIKey of magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide?
The InChIKey is PBKMUWOCWLFGAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2Si.Mg/c1-20(2,3)19(15-17-12-8-5-9-13-17)18-14-16-10-6-4-7-11-16;/h4-13H,1,14-15H2,2-3H3;/q-2;+2.
What are the key properties of magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide?
magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide has a molecular weight of 306.77 g/mol, XLogP of 4.18, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium benzyl-[benzyl-[methanidyl(dimethyl)silyl]amino]azanide is sourced from PubChem (CID 11232045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).