1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine

C13H23NSi2 — CID 12672258

IUPAC1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine
SMILESC[Si]1(C)CC[Si](C)(C)N1Cc1ccccc1
InChIInChI=1S/C13H23NSi2/c1-15(2)10-11-16(3,4)14(15)12-13-8-6-5-7-9-13/h5-9H,10-12H2,1-4H3
InChIKeyZWHJOKVPBMQCSF-UHFFFAOYSA-N
MW249.51 g/mol
LogP3.91
Rot. Bonds2

About 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine

1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine (PubChem CID 12672258) has the molecular formula C13H23NSi2 and a molecular weight of 249.51 g/mol. Its IUPAC name is 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine.

Molecular Properties

Compound Name1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine
PubChem CID12672258
Molecular FormulaC13H23NSi2
Molecular Weight249.51 g/mol
Exact Mass249.14
IUPAC Name1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine
SMILESC[Si]1(C)CC[Si](C)(C)N1Cc1ccccc1
InChIInChI=1S/C13H23NSi2/c1-15(2)10-11-16(3,4)14(15)12-13-8-6-5-7-9-13/h5-9H,10-12H2,1-4H3
InChIKeyZWHJOKVPBMQCSF-UHFFFAOYSA-N
XLogP3.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.51
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine?
The IUPAC name of 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine (CID 12672258) is 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine.
What is the SMILES notation for 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine?
The canonical SMILES for 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine is C[Si]1(C)CC[Si](C)(C)N1Cc1ccccc1.
What is the InChIKey of 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine?
The InChIKey is ZWHJOKVPBMQCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NSi2/c1-15(2)10-11-16(3,4)14(15)12-13-8-6-5-7-9-13/h5-9H,10-12H2,1-4H3.
What are the key properties of 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine?
1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine has a molecular weight of 249.51 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2,2,5,5-tetramethyl-1,2,5-azadisilolidine is sourced from PubChem (CID 12672258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).