dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane

C23H33NSi — CID 25149787

IUPACdibenzyl-methyl-(3-piperidin-1-ylpropyl)silane
SMILESC[Si](CCCN1CCCCC1)(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C23H33NSi/c1-25(20-22-12-5-2-6-13-22,21-23-14-7-3-8-15-23)19-11-18-24-16-9-4-10-17-24/h2-3,5-8,12-15H,4,9-11,16-21H2,1H3
InChIKeyHIRWVQYWXBSJGO-UHFFFAOYSA-N
MW351.61 g/mol
LogP5.50
Rot. Bonds8

About dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane

dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane (PubChem CID 25149787) has the molecular formula C23H33NSi and a molecular weight of 351.61 g/mol. Its IUPAC name is dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane.

Molecular Properties

Compound Namedibenzyl-methyl-(3-piperidin-1-ylpropyl)silane
PubChem CID25149787
Molecular FormulaC23H33NSi
Molecular Weight351.61 g/mol
Exact Mass351.24
IUPAC Namedibenzyl-methyl-(3-piperidin-1-ylpropyl)silane
SMILESC[Si](CCCN1CCCCC1)(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C23H33NSi/c1-25(20-22-12-5-2-6-13-22,21-23-14-7-3-8-15-23)19-11-18-24-16-9-4-10-17-24/h2-3,5-8,12-15H,4,9-11,16-21H2,1H3
InChIKeyHIRWVQYWXBSJGO-UHFFFAOYSA-N
XLogP5.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.61
LogP ≤ 55.50
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 dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane?
The IUPAC name of dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane (CID 25149787) is dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane.
What is the SMILES notation for dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane?
The canonical SMILES for dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane is C[Si](CCCN1CCCCC1)(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane?
The InChIKey is HIRWVQYWXBSJGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33NSi/c1-25(20-22-12-5-2-6-13-22,21-23-14-7-3-8-15-23)19-11-18-24-16-9-4-10-17-24/h2-3,5-8,12-15H,4,9-11,16-21H2,1H3.
What are the key properties of dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane?
dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane has a molecular weight of 351.61 g/mol, XLogP of 5.50, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzyl-methyl-(3-piperidin-1-ylpropyl)silane is sourced from PubChem (CID 25149787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).