(2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane

C27H33NSi — CID 162417479

IUPAC(2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane
SMILESCC(CN1CCCCC1)C[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H33NSi/c1-24(22-28-20-12-5-13-21-28)23-29(25-14-6-2-7-15-25,26-16-8-3-9-17-26)27-18-10-4-11-19-27/h2-4,6-11,14-19,24H,5,12-13,20-23H2,1H3
InChIKeyUXGIKINFHBUUHL-UHFFFAOYSA-N
MW399.65 g/mol
LogP4.28
Rot. Bonds7

About (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane

(2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane (PubChem CID 162417479) has the molecular formula C27H33NSi and a molecular weight of 399.65 g/mol. Its IUPAC name is (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane.

Molecular Properties

Compound Name(2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane
PubChem CID162417479
Molecular FormulaC27H33NSi
Molecular Weight399.65 g/mol
Exact Mass399.24
IUPAC Name(2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane
SMILESCC(CN1CCCCC1)C[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H33NSi/c1-24(22-28-20-12-5-13-21-28)23-29(25-14-6-2-7-15-25,26-16-8-3-9-17-26)27-18-10-4-11-19-27/h2-4,6-11,14-19,24H,5,12-13,20-23H2,1H3
InChIKeyUXGIKINFHBUUHL-UHFFFAOYSA-N
XLogP4.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.65
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane?
The IUPAC name of (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane (CID 162417479) is (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane.
What is the SMILES notation for (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane?
The canonical SMILES for (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane is CC(CN1CCCCC1)C[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane?
The InChIKey is UXGIKINFHBUUHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33NSi/c1-24(22-28-20-12-5-13-21-28)23-29(25-14-6-2-7-15-25,26-16-8-3-9-17-26)27-18-10-4-11-19-27/h2-4,6-11,14-19,24H,5,12-13,20-23H2,1H3.
What are the key properties of (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane?
(2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane has a molecular weight of 399.65 g/mol, XLogP of 4.28, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-3-piperidin-1-ylpropyl)-triphenylsilane is sourced from PubChem (CID 162417479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).