trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane

C31H29NSi — CID 156675550

IUPACtrimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane
SMILES[2H]C([2H])([2H])c1ccc(-c2ccc3cc([Si](C)(C)C)c(-c4ccccc4)cc3n2)cc1-c1ccccc1
InChIInChI=1S/C31H29NSi/c1-22-15-16-25(19-27(22)23-11-7-5-8-12-23)29-18-17-26-20-31(33(2,3)4)28(21-30(26)32-29)24-13-9-6-10-14-24/h5-21H,1-4H3/i1D3
InChIKeyCPDZNHKUNDMAKJ-FIBGUPNXSA-N
MW446.68 g/mol
LogP8.09
Rot. Bonds5

About trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane

trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane (PubChem CID 156675550) has the molecular formula C31H29NSi and a molecular weight of 446.68 g/mol. Its IUPAC name is trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane.

Molecular Properties

Compound Nametrimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane
PubChem CID156675550
Molecular FormulaC31H29NSi
Molecular Weight446.68 g/mol
Exact Mass446.23
IUPAC Nametrimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane
SMILES[2H]C([2H])([2H])c1ccc(-c2ccc3cc([Si](C)(C)C)c(-c4ccccc4)cc3n2)cc1-c1ccccc1
InChIInChI=1S/C31H29NSi/c1-22-15-16-25(19-27(22)23-11-7-5-8-12-23)29-18-17-26-20-31(33(2,3)4)28(21-30(26)32-29)24-13-9-6-10-14-24/h5-21H,1-4H3/i1D3
InChIKeyCPDZNHKUNDMAKJ-FIBGUPNXSA-N
XLogP8.09
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.68
LogP ≤ 58.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[4-(2-deuteriopropan-2-yl)-6-(4-methyl-3-phenylphenyl)-3-pyridinyl]-trimethylsilane
CID 166578513
trimethyl-[6-phenyl-2-(trideuteriomethyl)-3-pyridinyl]silane
CID 156657420
5-(5-isocyano-2-methylphenyl)-2-[3-phenyl-4-(trideuteriomethyl)phenyl]pyridine
CID 176849268
N-methyl-2-phenylquinolin-7-amine
CID 142776720
2-phenylbenzo[g]quinoline
CID 45113076
[2-(3,5-dimethylbenzene-6-id-1-yl)-7-phenylquinolin-6-yl]-trimethylsilane;(Z)-5-hydroxy-2,6-dimethylhept-4-en-3-one;iridium
CID 156675508
3-(2-methyl-5-phenylphenyl)benzo[f]quinoline
CID 122666731
[1,4-dimethyl-6-[2-methyl-5-phenyl-4-(trideuteriomethyl)phenyl]pyridin-1-ium-3-yl]-trimethylsilane
CID 163545923
trimethyl-[4-methyl-6-(3-methyl-4-phenylphenyl)-3-pyridinyl]silane
CID 166574256
2-phenylindeno[1,2-g]quinolin-10-one
CID 154625605
trimethyl-[4-phenyl-2-(5-phenyl-2-trimethylsilylphenyl)phenyl]silane
CID 138968702
(4,6-diphenyl-3-pyridinyl)-trimethylsilane
CID 140710428

Frequently Asked Questions

What is the IUPAC name of trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane?
The IUPAC name of trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane (CID 156675550) is trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane.
What is the SMILES notation for trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane?
The canonical SMILES for trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane is [2H]C([2H])([2H])c1ccc(-c2ccc3cc([Si](C)(C)C)c(-c4ccccc4)cc3n2)cc1-c1ccccc1.
What is the InChIKey of trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane?
The InChIKey is CPDZNHKUNDMAKJ-FIBGUPNXSA-N. The full InChI is InChI=1S/C31H29NSi/c1-22-15-16-25(19-27(22)23-11-7-5-8-12-23)29-18-17-26-20-31(33(2,3)4)28(21-30(26)32-29)24-13-9-6-10-14-24/h5-21H,1-4H3/i1D3.
What are the key properties of trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane?
trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane has a molecular weight of 446.68 g/mol, XLogP of 8.09, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[7-phenyl-2-[3-phenyl-4-(trideuteriomethyl)phenyl]quinolin-6-yl]silane is sourced from PubChem (CID 156675550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).