4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane

C20H26N2O4Si — CID 14118539

IUPAC4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane
SMILESc1ccc(N2CCO[Si]3(OCC2)OCCN(c2ccccc2)CCO3)cc1
InChIInChI=1S/C20H26N2O4Si/c1-3-7-19(8-4-1)21-11-15-23-27(24-16-12-21)25-17-13-22(14-18-26-27)20-9-5-2-6-10-20/h1-10H,11-18H2
InChIKeyPJPGEEZGWVTRQG-UHFFFAOYSA-N
MW386.52 g/mol
LogP2.53
Rot. Bonds2

About 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane

4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane (PubChem CID 14118539) has the molecular formula C20H26N2O4Si and a molecular weight of 386.52 g/mol. Its IUPAC name is 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane.

Molecular Properties

Compound Name4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane
PubChem CID14118539
Molecular FormulaC20H26N2O4Si
Molecular Weight386.52 g/mol
Exact Mass386.17
IUPAC Name4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane
SMILESc1ccc(N2CCO[Si]3(OCC2)OCCN(c2ccccc2)CCO3)cc1
InChIInChI=1S/C20H26N2O4Si/c1-3-7-19(8-4-1)21-11-15-23-27(24-16-12-21)25-17-13-22(14-18-26-27)20-9-5-2-6-10-20/h1-10H,11-18H2
InChIKeyPJPGEEZGWVTRQG-UHFFFAOYSA-N
XLogP2.53
TPSA43.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.52
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane?
The IUPAC name of 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane (CID 14118539) is 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane.
What is the SMILES notation for 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane?
The canonical SMILES for 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane is c1ccc(N2CCO[Si]3(OCC2)OCCN(c2ccccc2)CCO3)cc1.
What is the InChIKey of 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane?
The InChIKey is PJPGEEZGWVTRQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4Si/c1-3-7-19(8-4-1)21-11-15-23-27(24-16-12-21)25-17-13-22(14-18-26-27)20-9-5-2-6-10-20/h1-10H,11-18H2.
What are the key properties of 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane?
4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane has a molecular weight of 386.52 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,12-diphenyl-1,7,9,15-tetraoxa-4,12-diaza-8-silaspiro[7.7]pentadecane is sourced from PubChem (CID 14118539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).