trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane

C36H29NSi — CID 140721404

IUPACtrimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane
SMILESC[Si](C)(C)c1ccc(-c2ccc3c4ccc(-c5ccc6ccccc6c5)cc4c4ccccc4c3c2)nc1
InChIInChI=1S/C36H29NSi/c1-38(2,3)29-16-19-36(37-23-29)28-15-18-33-32-17-14-27(26-13-12-24-8-4-5-9-25(24)20-26)21-34(32)30-10-6-7-11-31(30)35(33)22-28/h4-23H,1-3H3
InChIKeyWSJFHPVBHYRDMT-UHFFFAOYSA-N
MW503.72 g/mol
LogP9.57
Rot. Bonds3

About trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane

trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane (PubChem CID 140721404) has the molecular formula C36H29NSi and a molecular weight of 503.72 g/mol. Its IUPAC name is trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane.

Molecular Properties

Compound Nametrimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane
PubChem CID140721404
Molecular FormulaC36H29NSi
Molecular Weight503.72 g/mol
Exact Mass503.21
IUPAC Nametrimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane
SMILESC[Si](C)(C)c1ccc(-c2ccc3c4ccc(-c5ccc6ccccc6c5)cc4c4ccccc4c3c2)nc1
InChIInChI=1S/C36H29NSi/c1-38(2,3)29-16-19-36(37-23-29)28-15-18-33-32-17-14-27(26-13-12-24-8-4-5-9-25(24)20-26)21-34(32)30-10-6-7-11-31(30)35(33)22-28/h4-23H,1-3H3
InChIKeyWSJFHPVBHYRDMT-UHFFFAOYSA-N
XLogP9.57
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500503.72
LogP ≤ 59.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

trimethyl-(6-phenanthren-2-yl-3-pyridinyl)silane
CID 164792219
trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane
CID 140721451
trimethyl-(6-phenanthren-1-yl-3-pyridinyl)silane
CID 156658273
trimethyl-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]silane
CID 171056374
2-naphthalen-2-yl-5-(10-naphthalen-2-ylanthracen-9-yl)pyridine
CID 121277468
2-(3-naphthalen-2-yl-5-triphenylen-2-ylphenyl)triphenylene
CID 123747688
2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-phenylpyridine
CID 90361384
[6-(9-ethylcarbazol-3-yl)-3-pyridinyl]-trimethylsilane
CID 140719536
trimethyl-[4-[4-(6-quinolin-2-ylnaphthalen-2-yl)phenyl]phenyl]silane
CID 171056328
trimethyl-[6-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]naphthalen-2-yl]silane
CID 58151270
[4-[3-(6-dibenzofuran-2-yl-3-pyridinyl)quinolin-7-yl]phenyl]-trimethylsilane
CID 169293694
[4-[7-[6-([1]benzofuro[2,3-b]pyridin-6-yl)-3-pyridinyl]naphthalen-2-yl]phenyl]-trimethylsilane
CID 169294079

Frequently Asked Questions

What is the IUPAC name of trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane?
The IUPAC name of trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane (CID 140721404) is trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane.
What is the SMILES notation for trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane?
The canonical SMILES for trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane is C[Si](C)(C)c1ccc(-c2ccc3c4ccc(-c5ccc6ccccc6c5)cc4c4ccccc4c3c2)nc1.
What is the InChIKey of trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane?
The InChIKey is WSJFHPVBHYRDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H29NSi/c1-38(2,3)29-16-19-36(37-23-29)28-15-18-33-32-17-14-27(26-13-12-24-8-4-5-9-25(24)20-26)21-34(32)30-10-6-7-11-31(30)35(33)22-28/h4-23H,1-3H3.
What are the key properties of trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane?
trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane has a molecular weight of 503.72 g/mol, XLogP of 9.57, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[6-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane is sourced from PubChem (CID 140721404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).