trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane

C18H23NSi — CID 11391887

IUPACtrimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane
SMILESC[Si](C)(C)c1c(-c2ccccc2)ncc2c1CCCC2
InChIInChI=1S/C18H23NSi/c1-20(2,3)18-16-12-8-7-11-15(16)13-19-17(18)14-9-5-4-6-10-14/h4-6,9-10,13H,7-8,11-12H2,1-3H3
InChIKeyICWYEJSOUJDDQL-UHFFFAOYSA-N
MW281.47 g/mol
LogP4.17
Rot. Bonds2

About trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane

trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane (PubChem CID 11391887) has the molecular formula C18H23NSi and a molecular weight of 281.47 g/mol. Its IUPAC name is trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane.

Molecular Properties

Compound Nametrimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane
PubChem CID11391887
Molecular FormulaC18H23NSi
Molecular Weight281.47 g/mol
Exact Mass281.16
IUPAC Nametrimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane
SMILESC[Si](C)(C)c1c(-c2ccccc2)ncc2c1CCCC2
InChIInChI=1S/C18H23NSi/c1-20(2,3)18-16-12-8-7-11-15(16)13-19-17(18)14-9-5-4-6-10-14/h4-6,9-10,13H,7-8,11-12H2,1-3H3
InChIKeyICWYEJSOUJDDQL-UHFFFAOYSA-N
XLogP4.17
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 54.17
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 trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane?
The IUPAC name of trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane (CID 11391887) is trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane.
What is the SMILES notation for trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane?
The canonical SMILES for trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane is C[Si](C)(C)c1c(-c2ccccc2)ncc2c1CCCC2.
What is the InChIKey of trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane?
The InChIKey is ICWYEJSOUJDDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NSi/c1-20(2,3)18-16-12-8-7-11-15(16)13-19-17(18)14-9-5-4-6-10-14/h4-6,9-10,13H,7-8,11-12H2,1-3H3.
What are the key properties of trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane?
trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane has a molecular weight of 281.47 g/mol, XLogP of 4.17, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3-phenyl-5,6,7,8-tetrahydroisoquinolin-4-yl)silane is sourced from PubChem (CID 11391887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).