4,4-diphenyl-1,4-azasilinane

C16H19NSi — CID 23274849

IUPAC4,4-diphenyl-1,4-azasilinane
SMILESc1ccc([Si]2(c3ccccc3)CCNCC2)cc1
InChIInChI=1S/C16H19NSi/c1-3-7-15(8-4-1)18(13-11-17-12-14-18)16-9-5-2-6-10-16/h1-10,17H,11-14H2
InChIKeyUSMARMWJTDPVLT-UHFFFAOYSA-N
MW253.42 g/mol
LogP1.85
Rot. Bonds2

About 4,4-diphenyl-1,4-azasilinane

4,4-diphenyl-1,4-azasilinane (PubChem CID 23274849) has the molecular formula C16H19NSi and a molecular weight of 253.42 g/mol. Its IUPAC name is 4,4-diphenyl-1,4-azasilinane.

Molecular Properties

Compound Name4,4-diphenyl-1,4-azasilinane
PubChem CID23274849
Molecular FormulaC16H19NSi
Molecular Weight253.42 g/mol
Exact Mass253.13
IUPAC Name4,4-diphenyl-1,4-azasilinane
SMILESc1ccc([Si]2(c3ccccc3)CCNCC2)cc1
InChIInChI=1S/C16H19NSi/c1-3-7-15(8-4-1)18(13-11-17-12-14-18)16-9-5-2-6-10-16/h1-10,17H,11-14H2
InChIKeyUSMARMWJTDPVLT-UHFFFAOYSA-N
XLogP1.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.42
LogP ≤ 51.85
H-Bond Donors ≤ 51
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 4,4-diphenyl-1,4-azasilinane?
The IUPAC name of 4,4-diphenyl-1,4-azasilinane (CID 23274849) is 4,4-diphenyl-1,4-azasilinane.
What is the SMILES notation for 4,4-diphenyl-1,4-azasilinane?
The canonical SMILES for 4,4-diphenyl-1,4-azasilinane is c1ccc([Si]2(c3ccccc3)CCNCC2)cc1.
What is the InChIKey of 4,4-diphenyl-1,4-azasilinane?
The InChIKey is USMARMWJTDPVLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NSi/c1-3-7-15(8-4-1)18(13-11-17-12-14-18)16-9-5-2-6-10-16/h1-10,17H,11-14H2.
What are the key properties of 4,4-diphenyl-1,4-azasilinane?
4,4-diphenyl-1,4-azasilinane has a molecular weight of 253.42 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diphenyl-1,4-azasilinane is sourced from PubChem (CID 23274849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).