trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane

C36H29NSi — CID 140721451

IUPACtrimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane
SMILESC[Si](C)(C)c1ccc(-c2ccc3c4ccc(-c5cccc6ccccc56)cc4c4ccccc4c3c2)nc1
InChIInChI=1S/C36H29NSi/c1-38(2,3)27-17-20-36(37-23-27)26-16-19-33-32-18-15-25(29-14-8-10-24-9-4-5-11-28(24)29)21-34(32)30-12-6-7-13-31(30)35(33)22-26/h4-23H,1-3H3
InChIKeySUXXGKKDUNBZTH-UHFFFAOYSA-N
MW503.72 g/mol
LogP9.57
Rot. Bonds3

About trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane

trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane (PubChem CID 140721451) has the molecular formula C36H29NSi and a molecular weight of 503.72 g/mol. Its IUPAC name is trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane.

Molecular Properties

Compound Nametrimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane
PubChem CID140721451
Molecular FormulaC36H29NSi
Molecular Weight503.72 g/mol
Exact Mass503.21
IUPAC Nametrimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane
SMILESC[Si](C)(C)c1ccc(-c2ccc3c4ccc(-c5cccc6ccccc56)cc4c4ccccc4c3c2)nc1
InChIInChI=1S/C36H29NSi/c1-38(2,3)27-17-20-36(37-23-27)26-16-19-33-32-18-15-25(29-14-8-10-24-9-4-5-11-28(24)29)21-34(32)30-12-6-7-13-31(30)35(33)22-26/h4-23H,1-3H3
InChIKeySUXXGKKDUNBZTH-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-(7-naphthalen-2-yltriphenylen-2-yl)-3-pyridinyl]silane
CID 140721404
trimethyl-(6-phenanthren-2-yl-3-pyridinyl)silane
CID 164792219
trimethyl-(6-phenanthren-1-yl-3-pyridinyl)silane
CID 156658273
carbanide;iridium;2-phenyl-6-(trideuteriomethyl)pyridine;trimethyl-[6-(10-naphthalen-1-yl-3H-triphenylen-3-id-2-yl)-3-pyridinyl]silane
CID 164737843
carbanide;iridium;2-phenyl-6-(trideuteriomethyl)pyridine;trimethyl-[6-(7-naphthalen-1-yl-3H-triphenylen-3-id-2-yl)-3-pyridinyl]silane
CID 164737838
9,10-dimethyl-3-naphthalen-1-ylphenanthrene
CID 158591349
[6-(9-ethylcarbazol-3-yl)-3-pyridinyl]-trimethylsilane
CID 140719536
trimethyl-[4-[4-[4-[3-(3-naphthalen-1-ylphenyl)phenyl]-6-[4-(4-trimethylsilylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]silane
CID 176645429
trimethyl-[5-(4-naphthalen-1-ylphenyl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaen-18-yl]silane
CID 140704933
iridium;2-(7-naphthalen-1-yl-3H-dibenzofuran-3-id-2-yl)-4-phenylpyridine;trimethyl-[6-(3-phenylbenzene-6-id-1-yl)-3-pyridinyl]silane
CID 169038570
trimethyl-[5-(4-naphthalen-1-ylphenyl)-21-thiapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaen-18-yl]silane
CID 140704928
2-[4-(7-naphthalen-1-ylnaphthalen-2-yl)phenyl]triphenylene
CID 123541562

Frequently Asked Questions

What is the IUPAC name of trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane?
The IUPAC name of trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane (CID 140721451) is trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane.
What is the SMILES notation for trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane?
The canonical SMILES for trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane is C[Si](C)(C)c1ccc(-c2ccc3c4ccc(-c5cccc6ccccc56)cc4c4ccccc4c3c2)nc1.
What is the InChIKey of trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane?
The InChIKey is SUXXGKKDUNBZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H29NSi/c1-38(2,3)27-17-20-36(37-23-27)26-16-19-33-32-18-15-25(29-14-8-10-24-9-4-5-11-28(24)29)21-34(32)30-12-6-7-13-31(30)35(33)22-26/h4-23H,1-3H3.
What are the key properties of trimethyl-[6-(7-naphthalen-1-yltriphenylen-2-yl)-3-pyridinyl]silane?
trimethyl-[6-(7-naphthalen-1-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-1-yltriphenylen-2-yl)-3-pyridinyl]silane is sourced from PubChem (CID 140721451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).