[4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane

C23H24N2Si — CID 11485093

IUPAC[4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane
SMILESCc1ccc2cc(-c3ccc([Si](C)(C)C)cc3)c3ccc(C)nc3c2n1
InChIInChI=1S/C23H24N2Si/c1-15-6-8-18-14-21(17-9-11-19(12-10-17)26(3,4)5)20-13-7-16(2)25-23(20)22(18)24-15/h6-14H,1-5H3
InChIKeyOYCRGTSJDNVMLU-UHFFFAOYSA-N
MW356.55 g/mol
LogP5.61
Rot. Bonds2

About [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane

[4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane (PubChem CID 11485093) has the molecular formula C23H24N2Si and a molecular weight of 356.55 g/mol. Its IUPAC name is [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane
PubChem CID11485093
Molecular FormulaC23H24N2Si
Molecular Weight356.55 g/mol
Exact Mass356.17
IUPAC Name[4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane
SMILESCc1ccc2cc(-c3ccc([Si](C)(C)C)cc3)c3ccc(C)nc3c2n1
InChIInChI=1S/C23H24N2Si/c1-15-6-8-18-14-21(17-9-11-19(12-10-17)26(3,4)5)20-13-7-16(2)25-23(20)22(18)24-15/h6-14H,1-5H3
InChIKeyOYCRGTSJDNVMLU-UHFFFAOYSA-N
XLogP5.61
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.55
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

5-[4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-2,9-dimethyl-1,10-phenanthroline
CID 102191847
5-[8-(2,9-dimethyl-1,10-phenanthrolin-5-yl)dibenzofuran-2-yl]-2,9-dimethyl-1,10-phenanthroline
CID 118067072
2,9-dimethyl-5-[3-(4-phenylnaphthalen-1-yl)phenyl]-1,10-phenanthroline
CID 171419180
2,9-dimethyl-4,7-bis(4-methylphenyl)-1,10-phenanthroline
CID 71202847
[4-[7-(4-dimethylsilylphenyl)-2,9-dimethyl-1,10-phenanthrolin-4-yl]phenyl]-dimethylsilane
CID 137328798
2-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]-9-methyl-4-phenyl-1,10-phenanthroline
CID 168818387
2,9-dimethyl-1,10-phenanthroline-5-carboxylic acid
CID 619875
[4-[3,8-bis(2,6-dimethylphenyl)-6-(4-trimethylsilylphenyl)pyren-1-yl]phenyl]-trimethylsilane
CID 59391265
2-methyl-4,7,9-triphenyl-1,10-phenanthroline
CID 58704555
2-cyclohexyl-4-[4-(3,4-diphenylphenyl)phenyl]-9-methyl-1,10-phenanthroline
CID 171419143
trimethyl-[4-[4-[7-(4-trimethylsilylphenyl)naphthalen-2-yl]phenyl]phenyl]silane
CID 169293615
2-methyl-9-[2-methyl-4-(9-methyl-7-phenyl-1,10-phenanthrolin-2-yl)phenyl]-4-phenyl-1,10-phenanthroline
CID 59736480

Frequently Asked Questions

What is the IUPAC name of [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane?
The IUPAC name of [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane (CID 11485093) is [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane.
What is the SMILES notation for [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane?
The canonical SMILES for [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane is Cc1ccc2cc(-c3ccc([Si](C)(C)C)cc3)c3ccc(C)nc3c2n1.
What is the InChIKey of [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane?
The InChIKey is OYCRGTSJDNVMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2Si/c1-15-6-8-18-14-21(17-9-11-19(12-10-17)26(3,4)5)20-13-7-16(2)25-23(20)22(18)24-15/h6-14H,1-5H3.
What are the key properties of [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane?
[4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane has a molecular weight of 356.55 g/mol, XLogP of 5.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,9-dimethyl-1,10-phenanthrolin-5-yl)phenyl]-trimethylsilane is sourced from PubChem (CID 11485093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).