bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane

C21H22N4Si — CID 91463022

IUPACbis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane
SMILESCc1ccc([Si](C2=NCCC=C2)(C2=NCCC=C2)c2ccccn2)cn1
InChIInChI=1S/C21H22N4Si/c1-17-11-12-18(16-25-17)26(19-8-2-5-13-22-19,20-9-3-6-14-23-20)21-10-4-7-15-24-21/h2-5,8-13,16H,6-7,14-15H2,1H3
InChIKeyBAJOWIVQTSWSPL-UHFFFAOYSA-N
MW358.52 g/mol
LogP2.23
Rot. Bonds4

About bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane

bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane (PubChem CID 91463022) has the molecular formula C21H22N4Si and a molecular weight of 358.52 g/mol. Its IUPAC name is bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane.

Molecular Properties

Compound Namebis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane
PubChem CID91463022
Molecular FormulaC21H22N4Si
Molecular Weight358.52 g/mol
Exact Mass358.16
IUPAC Namebis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane
SMILESCc1ccc([Si](C2=NCCC=C2)(C2=NCCC=C2)c2ccccn2)cn1
InChIInChI=1S/C21H22N4Si/c1-17-11-12-18(16-25-17)26(19-8-2-5-13-22-19,20-9-3-6-14-23-20)21-10-4-7-15-24-21/h2-5,8-13,16H,6-7,14-15H2,1H3
InChIKeyBAJOWIVQTSWSPL-UHFFFAOYSA-N
XLogP2.23
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.52
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane?
The IUPAC name of bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane (CID 91463022) is bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane.
What is the SMILES notation for bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane?
The canonical SMILES for bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane is Cc1ccc([Si](C2=NCCC=C2)(C2=NCCC=C2)c2ccccn2)cn1.
What is the InChIKey of bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane?
The InChIKey is BAJOWIVQTSWSPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4Si/c1-17-11-12-18(16-25-17)26(19-8-2-5-13-22-19,20-9-3-6-14-23-20)21-10-4-7-15-24-21/h2-5,8-13,16H,6-7,14-15H2,1H3.
What are the key properties of bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane?
bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane has a molecular weight of 358.52 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,3-dihydropyridin-6-yl)-(6-methyl-3-pyridinyl)-pyridin-2-ylsilane is sourced from PubChem (CID 91463022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).