(6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane

C40H28N8Si — CID 71124274

IUPAC(6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane
SMILESc1ccc(-c2ccc([Si](c3ccc(-c4ccncc4)nc3)(c3ccc(-c4cccnc4)nc3)c3ccc(-c4cccnc4)nc3)cn2)nc1
InChIInChI=1S/C40H28N8Si/c1-2-20-44-39(7-1)40-15-11-35(28-48-40)49(32-8-12-36(45-25-32)29-16-21-41-22-17-29,33-9-13-37(46-26-33)30-5-3-18-42-23-30)34-10-14-38(47-27-34)31-6-4-19-43-24-31/h1-28H
InChIKeyQMNPEWXIHXFESB-UHFFFAOYSA-N
MW648.81 g/mol
LogP4.89
Rot. Bonds8

About (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane

(6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane (PubChem CID 71124274) has the molecular formula C40H28N8Si and a molecular weight of 648.81 g/mol. Its IUPAC name is (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane.

Molecular Properties

Compound Name(6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane
PubChem CID71124274
Molecular FormulaC40H28N8Si
Molecular Weight648.81 g/mol
Exact Mass648.22
IUPAC Name(6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane
SMILESc1ccc(-c2ccc([Si](c3ccc(-c4ccncc4)nc3)(c3ccc(-c4cccnc4)nc3)c3ccc(-c4cccnc4)nc3)cn2)nc1
InChIInChI=1S/C40H28N8Si/c1-2-20-44-39(7-1)40-15-11-35(28-48-40)49(32-8-12-36(45-25-32)29-16-21-41-22-17-29,33-9-13-37(46-26-33)30-5-3-18-42-23-30)34-10-14-38(47-27-34)31-6-4-19-43-24-31/h1-28H
InChIKeyQMNPEWXIHXFESB-UHFFFAOYSA-N
XLogP4.89
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms49
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500648.81
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine
CID 5519
4,4'-Diphenyl-2,2'-bipyridine
CID 80259
2,3,5,6-Tetrakis(2-pyridyl)pyrazine
CID 3034360
2,5-Dipyridin-2-ylpyridine
CID 4580671
X 9121
CID 195376
Nemertelline
CID 3042423
4'-(4-Pyridyl)-2,2':6',2''-terpyridine
CID 11438308
2,6-Bis(2-pyridyl)-4-phenylpyridine
CID 4407216
2,2':4',2''-Terpyridine, 6'-(2-pyridinyl)-
CID 9972674
4'-(4-Methylphenyl)-2,2'-6',2''-terpyridine
CID 146114
1~4~,2~4~,3~4~-Tri-tert-butyl-1~2~,2~2~:2~6~,3~2~-terpyridine
CID 4229824
Tris[2,2'-bipyridine]ruthenium dichloride
CID 84353

Frequently Asked Questions

What is the IUPAC name of (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane?
The IUPAC name of (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane (CID 71124274) is (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane.
What is the SMILES notation for (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane?
The canonical SMILES for (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane is c1ccc(-c2ccc([Si](c3ccc(-c4ccncc4)nc3)(c3ccc(-c4cccnc4)nc3)c3ccc(-c4cccnc4)nc3)cn2)nc1.
What is the InChIKey of (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane?
The InChIKey is QMNPEWXIHXFESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H28N8Si/c1-2-20-44-39(7-1)40-15-11-35(28-48-40)49(32-8-12-36(45-25-32)29-16-21-41-22-17-29,33-9-13-37(46-26-33)30-5-3-18-42-23-30)34-10-14-38(47-27-34)31-6-4-19-43-24-31/h1-28H.
What are the key properties of (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane?
(6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane has a molecular weight of 648.81 g/mol, XLogP of 4.89, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (6-pyridin-2-yl-3-pyridinyl)-bis(6-pyridin-3-yl-3-pyridinyl)-(6-pyridin-4-yl-3-pyridinyl)silane is sourced from PubChem (CID 71124274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).