(1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane

C17H31NSi2 — CID 11120308

IUPAC(1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane
SMILESC[Si](C)(C)C1CCC([Si](C)(C)C)N1Cc1ccccc1
InChIInChI=1S/C17H31NSi2/c1-19(2,3)16-12-13-17(20(4,5)6)18(16)14-15-10-8-7-9-11-15/h7-11,16-17H,12-14H2,1-6H3
InChIKeyLNLCADQYZSMFEJ-UHFFFAOYSA-N
MW305.61 g/mol
LogP4.77
Rot. Bonds4

About (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane

(1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane (PubChem CID 11120308) has the molecular formula C17H31NSi2 and a molecular weight of 305.61 g/mol. Its IUPAC name is (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane.

Molecular Properties

Compound Name(1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane
PubChem CID11120308
Molecular FormulaC17H31NSi2
Molecular Weight305.61 g/mol
Exact Mass305.20
IUPAC Name(1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane
SMILESC[Si](C)(C)C1CCC([Si](C)(C)C)N1Cc1ccccc1
InChIInChI=1S/C17H31NSi2/c1-19(2,3)16-12-13-17(20(4,5)6)18(16)14-15-10-8-7-9-11-15/h7-11,16-17H,12-14H2,1-6H3
InChIKeyLNLCADQYZSMFEJ-UHFFFAOYSA-N
XLogP4.77
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.61
LogP ≤ 54.77
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 (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane?
The IUPAC name of (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane (CID 11120308) is (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane.
What is the SMILES notation for (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane?
The canonical SMILES for (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane is C[Si](C)(C)C1CCC([Si](C)(C)C)N1Cc1ccccc1.
What is the InChIKey of (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane?
The InChIKey is LNLCADQYZSMFEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NSi2/c1-19(2,3)16-12-13-17(20(4,5)6)18(16)14-15-10-8-7-9-11-15/h7-11,16-17H,12-14H2,1-6H3.
What are the key properties of (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane?
(1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane has a molecular weight of 305.61 g/mol, XLogP of 4.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzyl-5-trimethylsilylpyrrolidin-2-yl)-trimethylsilane is sourced from PubChem (CID 11120308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).