2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane

C14H27NSSi2 — CID 101066236

IUPAC2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane
SMILESC[Si]1(C)CCC[Si](C)(C)N1CCCc1cccs1
InChIInChI=1S/C14H27NSSi2/c1-17(2)12-7-13-18(3,4)15(17)10-5-8-14-9-6-11-16-14/h6,9,11H,5,7-8,10,12-13H2,1-4H3
InChIKeyPOTHGRRGJAPGFA-UHFFFAOYSA-N
MW297.62 g/mol
LogP4.80
Rot. Bonds4

About 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane

2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane (PubChem CID 101066236) has the molecular formula C14H27NSSi2 and a molecular weight of 297.62 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane
PubChem CID101066236
Molecular FormulaC14H27NSSi2
Molecular Weight297.62 g/mol
Exact Mass297.14
IUPAC Name2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane
SMILESC[Si]1(C)CCC[Si](C)(C)N1CCCc1cccs1
InChIInChI=1S/C14H27NSSi2/c1-17(2)12-7-13-18(3,4)15(17)10-5-8-14-9-6-11-16-14/h6,9,11H,5,7-8,10,12-13H2,1-4H3
InChIKeyPOTHGRRGJAPGFA-UHFFFAOYSA-N
XLogP4.80
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.62
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane?
The IUPAC name of 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane (CID 101066236) is 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane?
The canonical SMILES for 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane is C[Si]1(C)CCC[Si](C)(C)N1CCCc1cccs1.
What is the InChIKey of 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane?
The InChIKey is POTHGRRGJAPGFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NSSi2/c1-17(2)12-7-13-18(3,4)15(17)10-5-8-14-9-6-11-16-14/h6,9,11H,5,7-8,10,12-13H2,1-4H3.
What are the key properties of 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane?
2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane has a molecular weight of 297.62 g/mol, XLogP of 4.80, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-1-(3-thiophen-2-ylpropyl)-1,2,6-azadisilinane is sourced from PubChem (CID 101066236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).