[5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane

C86H128N4Si4+4 — CID 158203414

IUPAC[5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane
SMILESCCC(C)Cc1c[n+](C)c(-c2ccccc2C)cc1[Si](C)(C)C.CCC(CC)Cc1c[n+](C)c(-c2ccccc2C)cc1[Si](C)(C)C.Cc1ccccc1-c1cc([Si](C)(C)C)c(C2CCCC2)c[n+]1C.Cc1ccccc1-c1cc([Si](C)(C)C)c(C2CCCCC2)c[n+]1C
InChIInChI=1S/C22H32NSi.C22H34NSi.C21H30NSi.C21H32NSi/c1-17-11-9-10-14-19(17)21-15-22(24(3,4)5)20(16-23(21)2)18-12-7-6-8-13-18;1-8-18(9-2)14-19-16-23(4)21(15-22(19)24(5,6)7)20-13-11-10-12-17(20)3;1-16-10-6-9-13-18(16)20-14-21(23(3,4)5)19(15-22(20)2)17-11-7-8-12-17;1-8-16(2)13-18-15-22(4)20(14-21(18)23(5,6)7)19-12-10-9-11-17(19)3/h9-11,14-16,18H,6-8,12-13H2,1-5H3;10-13,15-16,18H,8-9,14H2,1-7H3;6,9-10,13-15,17H,7-8,11-12H2,1-5H3;9-12,14-16H,8,13H2,1-7H3/q4*+1
InChIKeyATSKWMWSXIEYIJ-UHFFFAOYSA-N
MW1330.34 g/mol
LogP19.40
Rot. Bonds17

About [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane

[5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane (PubChem CID 158203414) has the molecular formula C86H128N4Si4+4 and a molecular weight of 1330.34 g/mol. Its IUPAC name is [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane.

Molecular Properties

Compound Name[5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane
PubChem CID158203414
Molecular FormulaC86H128N4Si4+4
Molecular Weight1330.34 g/mol
Exact Mass1328.92
IUPAC Name[5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane
SMILESCCC(C)Cc1c[n+](C)c(-c2ccccc2C)cc1[Si](C)(C)C.CCC(CC)Cc1c[n+](C)c(-c2ccccc2C)cc1[Si](C)(C)C.Cc1ccccc1-c1cc([Si](C)(C)C)c(C2CCCC2)c[n+]1C.Cc1ccccc1-c1cc([Si](C)(C)C)c(C2CCCCC2)c[n+]1C
InChIInChI=1S/C22H32NSi.C22H34NSi.C21H30NSi.C21H32NSi/c1-17-11-9-10-14-19(17)21-15-22(24(3,4)5)20(16-23(21)2)18-12-7-6-8-13-18;1-8-18(9-2)14-19-16-23(4)21(15-22(19)24(5,6)7)20-13-11-10-12-17(20)3;1-16-10-6-9-13-18(16)20-14-21(23(3,4)5)19(15-22(20)2)17-11-7-8-12-17;1-8-16(2)13-18-15-22(4)20(14-21(18)23(5,6)7)19-12-10-9-11-17(19)3/h9-11,14-16,18H,6-8,12-13H2,1-5H3;10-13,15-16,18H,8-9,14H2,1-7H3;6,9-10,13-15,17H,7-8,11-12H2,1-5H3;9-12,14-16H,8,13H2,1-7H3/q4*+1
InChIKeyATSKWMWSXIEYIJ-UHFFFAOYSA-N
XLogP19.40
TPSA15.52 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms94
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001330.34
LogP ≤ 519.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane with MolForge

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Launch Full Analysis

Related Compounds

trimethyl-[1-methyl-2-(2-methylphenyl)-5-(2-methylpropyl)pyridin-1-ium-4-yl]silane
CID 157442242
[6-(5-cyclohexyl-2-methylphenyl)-1-methyl-4-(2-methylpropyl)pyridin-1-ium-3-yl]-trimethylsilane
CID 167365158
5-cyclohexyl-4-(6-cyclohexylnaphthalen-2-yl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium
CID 140830013
6-cyclohexyl-2-methyl-3-(2-methylphenyl)isoquinolin-2-ium
CID 170405417
5-cyclohexyl-4-[6-(4-cyclopentylphenyl)naphthalen-2-yl]-1-methyl-2-(2-methylphenyl)pyridin-1-ium
CID 140829935
4-ethyl-1-methyl-2-(2-methylphenyl)-5-(2-methylpropyl)pyridin-1-ium
CID 123730706
5-cyclohexyl-4-(7-cyclohexyldibenzothiophen-3-yl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium
CID 140830106
4-[6-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-yl)naphthalen-2-yl]-5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium
CID 140830105
[4-(3-ethyl-3-methylpentan-2-yl)-1-methyl-6-(2-methylphenyl)pyridin-1-ium-3-yl]-trimethylsilane
CID 167365261
4-cyclohexyl-1-methyl-2-(2-methylphenyl)quinolin-1-ium
CID 153466956
3-cyclohexyl-1,5-dimethyl-2-(2-methylphenyl)pyridin-1-ium
CID 140881300
8-deuterio-4-methyl-5-(2-methylphenyl)-4-azoniatricyclo[6.2.1.02,7]undeca-2,4,6-triene
CID 140708374

Frequently Asked Questions

What is the IUPAC name of [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane?
The IUPAC name of [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane (CID 158203414) is [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane.
What is the SMILES notation for [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane?
The canonical SMILES for [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane is CCC(C)Cc1c[n+](C)c(-c2ccccc2C)cc1[Si](C)(C)C.CCC(CC)Cc1c[n+](C)c(-c2ccccc2C)cc1[Si](C)(C)C.Cc1ccccc1-c1cc([Si](C)(C)C)c(C2CCCC2)c[n+]1C.Cc1ccccc1-c1cc([Si](C)(C)C)c(C2CCCCC2)c[n+]1C.
What is the InChIKey of [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane?
The InChIKey is ATSKWMWSXIEYIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32NSi.C22H34NSi.C21H30NSi.C21H32NSi/c1-17-11-9-10-14-19(17)21-15-22(24(3,4)5)20(16-23(21)2)18-12-7-6-8-13-18;1-8-18(9-2)14-19-16-23(4)21(15-22(19)24(5,6)7)20-13-11-10-12-17(20)3;1-16-10-6-9-13-18(16)20-14-21(23(3,4)5)19(15-22(20)2)17-11-7-8-12-17;1-8-16(2)13-18-15-22(4)20(14-21(18)23(5,6)7)19-12-10-9-11-17(19)3/h9-11,14-16,18H,6-8,12-13H2,1-5H3;10-13,15-16,18H,8-9,14H2,1-7H3;6,9-10,13-15,17H,7-8,11-12H2,1-5H3;9-12,14-16H,8,13H2,1-7H3/q4*+1.
What are the key properties of [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane?
[5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane has a molecular weight of 1330.34 g/mol, XLogP of 19.40, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [5-cyclohexyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-cyclopentyl-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;[5-(2-ethylbutyl)-1-methyl-2-(2-methylphenyl)pyridin-1-ium-4-yl]-trimethylsilane;trimethyl-[1-methyl-5-(2-methylbutyl)-2-(2-methylphenyl)pyridin-1-ium-4-yl]silane is sourced from PubChem (CID 158203414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).