1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum

C17H15N2Pt- — CID 58162919

IUPAC1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum
SMILESCc1cccc(C)c1-n1ccnc1-c1[c-]cccc1.[Pt]
InChIInChI=1S/C17H15N2.Pt/c1-13-7-6-8-14(2)16(13)19-12-11-18-17(19)15-9-4-3-5-10-15;/h3-9,11-12H,1-2H3;/q-1;
InChIKeyHRKZFHCPTAUIPX-UHFFFAOYSA-N
MW442.40 g/mol
LogP3.95
Rot. Bonds2

About 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum

1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum (PubChem CID 58162919) has the molecular formula C17H15N2Pt- and a molecular weight of 442.40 g/mol. Its IUPAC name is 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum.

Molecular Properties

Compound Name1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum
PubChem CID58162919
Molecular FormulaC17H15N2Pt-
Molecular Weight442.40 g/mol
Exact Mass442.09
IUPAC Name1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum
SMILESCc1cccc(C)c1-n1ccnc1-c1[c-]cccc1.[Pt]
InChIInChI=1S/C17H15N2.Pt/c1-13-7-6-8-14(2)16(13)19-12-11-18-17(19)15-9-4-3-5-10-15;/h3-9,11-12H,1-2H3;/q-1;
InChIKeyHRKZFHCPTAUIPX-UHFFFAOYSA-N
XLogP3.95
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.40
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

butan-2-ol;1-(2,6-dimethylphenyl)-2-phenylimidazole;iridium
CID 155610263
1-(2,6-dimethylphenyl)-2-phenylimidazole;iridium;2-phenylquinoline
CID 140663295
1-(2,6-dimethylphenyl)-2-(4-methylbenzene-6-id-1-yl)imidazole;iridium
CID 58750753
iridium;oxalic acid;2-phenyl-1-(2,4,6-trimethylphenyl)imidazole
CID 153499828
1-(2,6-dimethyl-4-phenoxyphenyl)-2-phenylimidazole;iridium
CID 58947249
tris(1-[2-(2,6-dimethylphenyl)-6-propan-2-ylphenyl]-2-phenylimidazole);iridium(3+)
CID 86292659
iridium(3+);tris(1-phenyl-2-phenylimidazole)
CID 58401377
1-[2,6-bis(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)phenyl]-2-phenylimidazole;iridium
CID 59546936
bis(1-[2,6-di(propan-2-yl)phenyl]-2-phenylimidazole);iridium(3+);2-phenylpyridine
CID 170539461
iridium;1-naphthalen-1-yl-2-phenylimidazole
CID 58113418
iridium(3+);tris(1-(4-methoxyphenyl)-2-phenylimidazole)
CID 59348298
tris(1-[2,6-dimethyl-4-(8-methyldibenzofuran-2-yl)phenyl]-2-phenylimidazole);iridium(3+)
CID 58947408

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum?
The IUPAC name of 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum (CID 58162919) is 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum.
What is the SMILES notation for 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum?
The canonical SMILES for 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum is Cc1cccc(C)c1-n1ccnc1-c1[c-]cccc1.[Pt].
What is the InChIKey of 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum?
The InChIKey is HRKZFHCPTAUIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N2.Pt/c1-13-7-6-8-14(2)16(13)19-12-11-18-17(19)15-9-4-3-5-10-15;/h3-9,11-12H,1-2H3;/q-1;.
What are the key properties of 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum?
1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum has a molecular weight of 442.40 g/mol, XLogP of 3.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylphenyl)-2-phenylimidazole;platinum is sourced from PubChem (CID 58162919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).