trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane

C22H24NOSi+ — CID 167365206

IUPACtrimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane
SMILESCc1cc2oc3ccccc3c2cc1-c1ccc([Si](C)(C)C)c[n+]1C
InChIInChI=1S/C22H24NOSi/c1-15-12-22-19(17-8-6-7-9-21(17)24-22)13-18(15)20-11-10-16(14-23(20)2)25(3,4)5/h6-14H,1-5H3/q+1
InChIKeyOVXNKVFOWJXJML-UHFFFAOYSA-N
MW346.53 g/mol
LogP4.93
Rot. Bonds2

About trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane

trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane (PubChem CID 167365206) has the molecular formula C22H24NOSi+ and a molecular weight of 346.53 g/mol. Its IUPAC name is trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane.

Molecular Properties

Compound Nametrimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane
PubChem CID167365206
Molecular FormulaC22H24NOSi+
Molecular Weight346.53 g/mol
Exact Mass346.16
IUPAC Nametrimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane
SMILESCc1cc2oc3ccccc3c2cc1-c1ccc([Si](C)(C)C)c[n+]1C
InChIInChI=1S/C22H24NOSi/c1-15-12-22-19(17-8-6-7-9-21(17)24-22)13-18(15)20-11-10-16(14-23(20)2)25(3,4)5/h6-14H,1-5H3/q+1
InChIKeyOVXNKVFOWJXJML-UHFFFAOYSA-N
XLogP4.93
TPSA17.02 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.53
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-(1,5-dimethylpyridin-1-ium-2-yl)-3,7-dimethyl-[1]benzofuro[2,3-c]pyridine
CID 160809491
7-(1,5-dimethylpyridin-1-ium-2-yl)-8-methyl-[1]benzofuro[3,2-c]pyridine
CID 159117597
2-methyl-3-(6-methyl-10-oxapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4(9),5,7,12,14,16,18,20-decaen-7-yl)isoquinolin-2-ium
CID 176787840
7-methyl-8-(1,4,5-trimethylpyridin-1-ium-2-yl)dibenzofuran-1-carbonitrile
CID 170251327
trimethyl-[1-methyl-6-[2-methyl-5-(2-methylpropyl)phenyl]pyridin-1-ium-3-yl]silane
CID 158022992
1-methyl-2-(2-methyl-[1]benzofuro[2,3-b][1]benzofuran-3-yl)pyridin-1-ium
CID 140827979
10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4,6,8,11,14,16,18-nonaene;ethane
CID 154692122
1-methyl-2-(7-methyl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-8-yl)-5-(trideuteriomethyl)pyridin-1-ium
CID 153418212
[6-[4-(1,1-dideuterio-2,2-dimethylpropyl)-5-fluoro-2-methylphenyl]-1-methylpyridin-1-ium-3-yl]-trimethylsilane
CID 171723647
trimethyl-[4-[4-[1-methyl-2-(3-methyldibenzofuran-4-yl)-5-(trideuteriomethyl)pyridin-1-ium-4-yl]-3,5-bis(trideuteriomethyl)phenyl]phenyl]silane
CID 171723727
trimethyl-[1-methyl-6-(3-methyldibenzothiophen-4-yl)pyridin-1-ium-3-yl]silane
CID 167365003
[4-[4-[3-(4-dibenzofuran-2-ylphenyl)phenyl]phenyl]phenyl]-trimethylsilane
CID 171056465

Frequently Asked Questions

What is the IUPAC name of trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane?
The IUPAC name of trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane (CID 167365206) is trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane.
What is the SMILES notation for trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane?
The canonical SMILES for trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane is Cc1cc2oc3ccccc3c2cc1-c1ccc([Si](C)(C)C)c[n+]1C.
What is the InChIKey of trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane?
The InChIKey is OVXNKVFOWJXJML-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24NOSi/c1-15-12-22-19(17-8-6-7-9-21(17)24-22)13-18(15)20-11-10-16(14-23(20)2)25(3,4)5/h6-14H,1-5H3/q+1.
What are the key properties of trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane?
trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane has a molecular weight of 346.53 g/mol, XLogP of 4.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1-methyl-6-(3-methyldibenzofuran-2-yl)pyridin-1-ium-3-yl]silane is sourced from PubChem (CID 167365206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).