N-benzyl-N-trimethylsilylethanamine

C12H21NSi — CID 518980

IUPACN-benzyl-N-trimethylsilylethanamine
SMILESCCN(Cc1ccccc1)[Si](C)(C)C
InChIInChI=1S/C12H21NSi/c1-5-13(14(2,3)4)11-12-9-7-6-8-10-12/h6-10H,5,11H2,1-4H3
InChIKeyIVTNHFPTOGXRGQ-UHFFFAOYSA-N
MW207.39 g/mol
LogP3.34
Rot. Bonds4

About N-benzyl-N-trimethylsilylethanamine

N-benzyl-N-trimethylsilylethanamine (PubChem CID 518980) has the molecular formula C12H21NSi and a molecular weight of 207.39 g/mol. Its IUPAC name is N-benzyl-N-trimethylsilylethanamine.

Molecular Properties

Compound NameN-benzyl-N-trimethylsilylethanamine
PubChem CID518980
Molecular FormulaC12H21NSi
Molecular Weight207.39 g/mol
Exact Mass207.14
IUPAC NameN-benzyl-N-trimethylsilylethanamine
SMILESCCN(Cc1ccccc1)[Si](C)(C)C
InChIInChI=1S/C12H21NSi/c1-5-13(14(2,3)4)11-12-9-7-6-8-10-12/h6-10H,5,11H2,1-4H3
InChIKeyIVTNHFPTOGXRGQ-UHFFFAOYSA-N
XLogP3.34
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.39
LogP ≤ 53.34
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 N-benzyl-N-trimethylsilylethanamine?
The IUPAC name of N-benzyl-N-trimethylsilylethanamine (CID 518980) is N-benzyl-N-trimethylsilylethanamine.
What is the SMILES notation for N-benzyl-N-trimethylsilylethanamine?
The canonical SMILES for N-benzyl-N-trimethylsilylethanamine is CCN(Cc1ccccc1)[Si](C)(C)C.
What is the InChIKey of N-benzyl-N-trimethylsilylethanamine?
The InChIKey is IVTNHFPTOGXRGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NSi/c1-5-13(14(2,3)4)11-12-9-7-6-8-10-12/h6-10H,5,11H2,1-4H3.
What are the key properties of N-benzyl-N-trimethylsilylethanamine?
N-benzyl-N-trimethylsilylethanamine has a molecular weight of 207.39 g/mol, XLogP of 3.34, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-trimethylsilylethanamine is sourced from PubChem (CID 518980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).