2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole

C21H31NSi2 — CID 11810352

IUPAC2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole
SMILESCC[Si]1(CC)c2ccccc2[Si](CC)(CC)N1Cc1ccccc1
InChIInChI=1S/C21H31NSi2/c1-5-23(6-2)20-16-12-13-17-21(20)24(7-3,8-4)22(23)18-19-14-10-9-11-15-19/h9-17H,5-8,18H2,1-4H3
InChIKeyQAOVUCULXBMNHW-UHFFFAOYSA-N
MW353.66 g/mol
LogP4.59
Rot. Bonds6

About 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole

2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole (PubChem CID 11810352) has the molecular formula C21H31NSi2 and a molecular weight of 353.66 g/mol. Its IUPAC name is 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole.

Molecular Properties

Compound Name2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole
PubChem CID11810352
Molecular FormulaC21H31NSi2
Molecular Weight353.66 g/mol
Exact Mass353.20
IUPAC Name2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole
SMILESCC[Si]1(CC)c2ccccc2[Si](CC)(CC)N1Cc1ccccc1
InChIInChI=1S/C21H31NSi2/c1-5-23(6-2)20-16-12-13-17-21(20)24(7-3,8-4)22(23)18-19-14-10-9-11-15-19/h9-17H,5-8,18H2,1-4H3
InChIKeyQAOVUCULXBMNHW-UHFFFAOYSA-N
XLogP4.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.66
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Disilazane, 2-benzyl-1,1,1,3,3,3-hexamethyl-
CID 616728
Pyrrolidine, 1-(phenylmethyl)-2,5-bis(trimethylsilyl)-
CID 11120308
N-benzyl-4-[(1S)-2,3-dihydro-1H-1-benzosilol-1-yl]-N-methylbutan-1-amine
CID 177930185
N-benzyl-N,1-bis[fluoro(dimethyl)silyl]-1-phenylmethanamine
CID 12077704
1-[(2,4-Difluorophenyl)methyl]-2,2,5,5-tetramethyl-1,2,5-azadisilolidine
CID 19980941
1-Benzyl-2,2,5,5-tetramethyl-2,5-disilapyrrolidine
CID 12672258
1-Benzyl-2,2,6,6-tetramethyl-2,6-disilapiperidine
CID 14195385
N-Benzyl-1-methyl-1-phenylsilanamine
CID 15653410
N,N-bis[ethenyl(dimethyl)silyl]-1-phenylmethanamine
CID 140840990
1,1,3,3-tetramethyl-2-[(E)-2-phenylethenyl]-2,1,3-benzazadisilole
CID 12736307
Lithium;bis(benzyl(trimethylsilyl)azanide);copper(1+)
CID 15298187
[Dimethyl(phenyl)silyl]-phenylmethanamine
CID 101007580

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole?
The IUPAC name of 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole (CID 11810352) is 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole.
What is the SMILES notation for 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole?
The canonical SMILES for 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole is CC[Si]1(CC)c2ccccc2[Si](CC)(CC)N1Cc1ccccc1.
What is the InChIKey of 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole?
The InChIKey is QAOVUCULXBMNHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31NSi2/c1-5-23(6-2)20-16-12-13-17-21(20)24(7-3,8-4)22(23)18-19-14-10-9-11-15-19/h9-17H,5-8,18H2,1-4H3.
What are the key properties of 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole?
2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole has a molecular weight of 353.66 g/mol, XLogP of 4.59, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-1,1,3,3-tetraethyl-2,1,3-benzazadisilole is sourced from PubChem (CID 11810352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).