[6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane

C24H29NSi — CID 166578341

IUPAC[6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane
SMILESC=[N+]1C=C([Si](C)(C)C)C(C)=C[C-]1c1cc(-c2ccccc2)c(C)cc1C
InChIInChI=1S/C24H29NSi/c1-17-13-18(2)22(15-21(17)20-11-9-8-10-12-20)23-14-19(3)24(16-25(23)4)26(5,6)7/h8-16H,4H2,1-3,5-7H3
InChIKeyKVLSTEINRBACBT-UHFFFAOYSA-N
MW359.59 g/mol
LogP6.28
Rot. Bonds3

About [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane

[6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane (PubChem CID 166578341) has the molecular formula C24H29NSi and a molecular weight of 359.59 g/mol. Its IUPAC name is [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane.

Molecular Properties

Compound Name[6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane
PubChem CID166578341
Molecular FormulaC24H29NSi
Molecular Weight359.59 g/mol
Exact Mass359.21
IUPAC Name[6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane
SMILESC=[N+]1C=C([Si](C)(C)C)C(C)=C[C-]1c1cc(-c2ccccc2)c(C)cc1C
InChIInChI=1S/C24H29NSi/c1-17-13-18(2)22(15-21(17)20-11-9-8-10-12-20)23-14-19(3)24(16-25(23)4)26(5,6)7/h8-16H,4H2,1-3,5-7H3
InChIKeyKVLSTEINRBACBT-UHFFFAOYSA-N
XLogP6.28
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.59
LogP ≤ 56.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

[4-(cyclopentylmethyl)-6-(2,5-dimethyl-4-phenylphenyl)-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane
CID 166575824
1,4-bis(2,4-dimethyl-5-phenylphenyl)-2,5-bis(2-methylphenyl)benzene
CID 59609379
2-methyl-1-phenyl-4-(2-phenylphenyl)benzene
CID 59171665
2-(4-methyl-5-phenyl-2-pyridin-2-ylphenyl)pyridine
CID 146397355
4-fluoro-1-methyl-2-phenylbenzene
CID 21350138
2,3,6-trimethyl-5-phenylpyridine
CID 102473268
1,5-bis(2,4-dimethylphenyl)-3-phenylpyrazole
CID 177442441
[1,4-dimethyl-6-[2-methyl-5-phenyl-4-(trideuteriomethyl)phenyl]pyridin-1-ium-3-yl]-trimethylsilane
CID 163545923
5-methyl-6-phenyl-2,3-dihydro-1-benzofuran
CID 12878338
2-iodo-4-(2-methylphenyl)-1-phenylbenzene
CID 170132192
1,4-dimethyl-2-phenyl-5-[(E)-prop-1-enyl]benzene
CID 170552806
2,5-dimethyl-4-phenylpyridine
CID 603086

Frequently Asked Questions

What is the IUPAC name of [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane?
The IUPAC name of [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane (CID 166578341) is [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane.
What is the SMILES notation for [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane?
The canonical SMILES for [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane is C=[N+]1C=C([Si](C)(C)C)C(C)=C[C-]1c1cc(-c2ccccc2)c(C)cc1C.
What is the InChIKey of [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane?
The InChIKey is KVLSTEINRBACBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29NSi/c1-17-13-18(2)22(15-21(17)20-11-9-8-10-12-20)23-14-19(3)24(16-25(23)4)26(5,6)7/h8-16H,4H2,1-3,5-7H3.
What are the key properties of [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane?
[6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane has a molecular weight of 359.59 g/mol, XLogP of 6.28, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,4-dimethyl-5-phenylphenyl)-4-methyl-1-methylidenepyridin-1-ium-6-id-3-yl]-trimethylsilane is sourced from PubChem (CID 166578341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).