tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane

C16H25NSi — CID 165071230

IUPACtert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane
SMILESCc1cc(C#C[Si](C)(C)C(C)(C)C)nc(C)c1C
InChIInChI=1S/C16H25NSi/c1-12-11-15(17-14(3)13(12)2)9-10-18(7,8)16(4,5)6/h11H,1-8H3
InChIKeyIIWOWWMKYUBINX-UHFFFAOYSA-N
MW259.47 g/mol
LogP4.41
Rot. Bonds

About tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane

tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane (PubChem CID 165071230) has the molecular formula C16H25NSi and a molecular weight of 259.47 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane
PubChem CID165071230
Molecular FormulaC16H25NSi
Molecular Weight259.47 g/mol
Exact Mass259.18
IUPAC Nametert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane
SMILESCc1cc(C#C[Si](C)(C)C(C)(C)C)nc(C)c1C
InChIInChI=1S/C16H25NSi/c1-12-11-15(17-14(3)13(12)2)9-10-18(7,8)16(4,5)6/h11H,1-8H3
InChIKeyIIWOWWMKYUBINX-UHFFFAOYSA-N
XLogP4.41
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.47
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane?
The IUPAC name of tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane (CID 165071230) is tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane is Cc1cc(C#C[Si](C)(C)C(C)(C)C)nc(C)c1C.
What is the InChIKey of tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane?
The InChIKey is IIWOWWMKYUBINX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NSi/c1-12-11-15(17-14(3)13(12)2)9-10-18(7,8)16(4,5)6/h11H,1-8H3.
What are the key properties of tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane?
tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane has a molecular weight of 259.47 g/mol, XLogP of 4.41, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[2-(4,5,6-trimethyl-2-pyridinyl)ethynyl]silane is sourced from PubChem (CID 165071230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).