trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane

C15H22N2Si — CID 19694299

IUPACtrimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane
SMILESCN1CCCC1c1cncc(C#C[Si](C)(C)C)c1
InChIInChI=1S/C15H22N2Si/c1-17-8-5-6-15(17)14-10-13(11-16-12-14)7-9-18(2,3)4/h10-12,15H,5-6,8H2,1-4H3
InChIKeyUTBQXVHKOVFDCS-UHFFFAOYSA-N
MW258.44 g/mol
LogP3.08
Rot. Bonds1

About trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane

trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane (PubChem CID 19694299) has the molecular formula C15H22N2Si and a molecular weight of 258.44 g/mol. Its IUPAC name is trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane
PubChem CID19694299
Molecular FormulaC15H22N2Si
Molecular Weight258.44 g/mol
Exact Mass258.16
IUPAC Nametrimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane
SMILESCN1CCCC1c1cncc(C#C[Si](C)(C)C)c1
InChIInChI=1S/C15H22N2Si/c1-17-8-5-6-15(17)14-10-13(11-16-12-14)7-9-18(2,3)4/h10-12,15H,5-6,8H2,1-4H3
InChIKeyUTBQXVHKOVFDCS-UHFFFAOYSA-N
XLogP3.08
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.44
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane?
The IUPAC name of trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane (CID 19694299) is trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane.
What is the SMILES notation for trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane?
The canonical SMILES for trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane is CN1CCCC1c1cncc(C#C[Si](C)(C)C)c1.
What is the InChIKey of trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane?
The InChIKey is UTBQXVHKOVFDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2Si/c1-17-8-5-6-15(17)14-10-13(11-16-12-14)7-9-18(2,3)4/h10-12,15H,5-6,8H2,1-4H3.
What are the key properties of trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane?
trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane has a molecular weight of 258.44 g/mol, XLogP of 3.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[5-(1-methylpyrrolidin-2-yl)-3-pyridinyl]ethynyl]silane is sourced from PubChem (CID 19694299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).