2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum

C30H21N2Pt-3 — CID 171732600

IUPAC2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum
SMILESCc1c[c-]c(-c2ccccn2)cc1.[Pt].[c-]1ccccc1-n1c2[c-]cccc2c2ccccc21
InChIInChI=1S/C18H11N.C12H10N.Pt/c1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;1-10-5-7-11(8-6-10)12-4-2-3-9-13-12;/h1-8,10-12H;2-7,9H,1H3;/q-2;-1;
InChIKeyRBBDKODXUPGJCM-UHFFFAOYSA-N
MW604.59 g/mol
LogP7.24
Rot. Bonds2

About 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum

2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum (PubChem CID 171732600) has the molecular formula C30H21N2Pt-3 and a molecular weight of 604.59 g/mol. Its IUPAC name is 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum.

Molecular Properties

Compound Name2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum
PubChem CID171732600
Molecular FormulaC30H21N2Pt-3
Molecular Weight604.59 g/mol
Exact Mass604.14
IUPAC Name2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum
SMILESCc1c[c-]c(-c2ccccn2)cc1.[Pt].[c-]1ccccc1-n1c2[c-]cccc2c2ccccc21
InChIInChI=1S/C18H11N.C12H10N.Pt/c1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;1-10-5-7-11(8-6-10)12-4-2-3-9-13-12;/h1-8,10-12H;2-7,9H,1H3;/q-2;-1;
InChIKeyRBBDKODXUPGJCM-UHFFFAOYSA-N
XLogP7.24
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500604.59
LogP ≤ 57.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[2-[3-(4,4-dimethylcyclohexyl)-5-[2-(4-pyridin-2-ylbenzene-5-id-1-yl)ethyl]phenyl]ethyl]-2-(4-methylbenzene-6-id-1-yl)pyridine;iridium(3+);9-pyridin-2-yl-1H-carbazol-1-ide
CID 171438390
9-[3-[3-[6-[3-(3-carbazol-9-ylphenyl)phenyl]-4-phenyl-2-pyridinyl]phenyl]phenyl]carbazole;iridium;2-(4-methylbenzene-6-id-1-yl)pyridine
CID 161394492
tris(iridium(3+));tris(2-phenylpyridine);hexakis(9-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]carbazole)
CID 162273497
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;iridium;2-phenylpyridine
CID 161358611
iridium;4-(4-methylbenzene-6-id-1-yl)furo[3,2-c]pyridine;2-phenylpyridine
CID 140788908
iridium;2-(4-methylbenzene-6-id-1-yl)pyridine;2-phenylbenzo[f]isoquinoline
CID 59470354
iridium;2-phenylpyridine;9-(3-pyridin-2-ylbenzene-4-id-1-yl)carbazole
CID 21042137
9-[3-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;9-[3-[2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]pyrido[2,3-b]indole;2-(4-carbazol-9-yl-3-methyl-2H-imidazol-2-id-1-yl)-9-(9-phenyl-1H-carbazol-1-id-2-yl)-1H-carbazol-1-ide;platinum;platinum(4+)
CID 157113526
2-(4-ethenylbenzene-6-id-1-yl)pyridine;iridium;2-(4-methylbenzene-6-id-1-yl)pyridine
CID 59307411
bis(10H-benzo[h]quinolin-10-ide);tetrakis(iridium(3+));bis(2-(4-methylbenzene-6-id-1-yl)pyridine);octakis(2-phenylpyridine)
CID 157371936
iridium(3+);9-(2-methylpropyl)-2-(4-methyl-2-pyridinyl)-3H-carbazol-3-ide;bis(2-phenylpyridine)
CID 59500188
CID 169309312
CID 169309312

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum?
The IUPAC name of 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum (CID 171732600) is 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum.
What is the SMILES notation for 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum?
The canonical SMILES for 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum is Cc1c[c-]c(-c2ccccn2)cc1.[Pt].[c-]1ccccc1-n1c2[c-]cccc2c2ccccc21.
What is the InChIKey of 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum?
The InChIKey is RBBDKODXUPGJCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11N.C12H10N.Pt/c1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;1-10-5-7-11(8-6-10)12-4-2-3-9-13-12;/h1-8,10-12H;2-7,9H,1H3;/q-2;-1;.
What are the key properties of 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum?
2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum has a molecular weight of 604.59 g/mol, XLogP of 7.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylbenzene-6-id-1-yl)pyridine;9-phenyl-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 171732600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).