2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid

C101H98F3Ir5N13O8Pt-6 — CID 160806251

About 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid

2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid (PubChem CID 160806251) has the molecular formula C101H98F3Ir5N13O8Pt-6 and a molecular weight of 2835.13 g/mol. Its IUPAC name is 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid.

Molecular Properties

• Compound Name: 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid
• PubChem CID: 160806251
• Molecular Formula: C101H98F3Ir5N13O8Pt-6
• Molecular Weight: 2835.13 g/mol
• Exact Mass: 2837.54
• IUPAC Name: 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid
• SMILES: CC(=O)C=C(C)O.CC(C)(C)C(=O)C=C(O)C(C)(C)C.CC(C)(C)c1n[c-]c(-c2ccccn2)o1.CCn1cn[c-]c1-c1ccccn1.Cc1c[c-]c(-c2ccccn2)o1.Cc1ccc(-c2[c-]ccn2-c2ccccc2)nc1.FC(F)(F)c1ccc(-c2[c-]ccn2-c2ccccc2)nc1.O=C(O)c1ccccn1.[Ir].[Ir].[Ir].[Ir].[Ir].[Pt].[c-]1ccn(-c2ccccc2)c1-c1ccccn1
• InChI: InChI=1S/C16H10F3N2.C16H13N2.C15H11N2.C12H13N2O.C11H20O2.C10H10N3.C10H8NO.C6H5NO2.C5H8O2.5Ir.Pt/c17-16(18,19)12-8-9-14(20-11-12)15-7-4-10-21(15)13-5-2-1-3-6-13;1-13-9-10-15(17-12-13)16-8-5-11-18(16)14-6-3-2-4-7-14;1-2-7-13(8-3-1)17-12-6-10-15(17)14-9-4-5-11-16-14;1-12(2,3)11-14-8-10(15-11)9-6-4-5-7-13-9;1-10(2,3)8(12)7-9(13)11(4,5)6;1-2-13-8-11-7-10(13)9-5-3-4-6-12-9;1-8-5-6-10(12-8)9-4-2-3-7-11-9;8-6(9)5-3-1-2-4-7-5;1-4(6)3-5(2)7;;;;;;/h1-6,8-11H;2-7,9-12H,1H3;1-9,11-12H;4-7H,1-3H3;7,12H,1-6H3;3-6,8H,2H2,1H3;2-5,7H,1H3;1-4H,(H,8,9);3,6H,1-2H3;;;;;;/q4*-1;;2*-1
• InChIKey: ZAKIGFASXLTXSV-UHFFFAOYSA-N
• XLogP: 23.29
• TPSA: 273.91 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 20
• Rotatable Bonds: 13
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2835.13
LogP ≤ 5	23.29
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid?

The IUPAC name of 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid (CID 160806251) is 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid.

What is the SMILES notation for 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid?

The canonical SMILES for 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid is CC(=O)C=C(C)O.CC(C)(C)C(=O)C=C(O)C(C)(C)C.CC(C)(C)c1n[c-]c(-c2ccccn2)o1.CCn1cn[c-]c1-c1ccccn1.Cc1c[c-]c(-c2ccccn2)o1.Cc1ccc(-c2[c-]ccn2-c2ccccc2)nc1.FC(F)(F)c1ccc(-c2[c-]ccn2-c2ccccc2)nc1.O=C(O)c1ccccn1.[Ir].[Ir].[Ir].[Ir].[Ir].[Pt].[c-]1ccn(-c2ccccc2)c1-c1ccccn1.

What is the InChIKey of 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid?

The InChIKey is ZAKIGFASXLTXSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3N2.C16H13N2.C15H11N2.C12H13N2O.C11H20O2.C10H10N3.C10H8NO.C6H5NO2.C5H8O2.5Ir.Pt/c17-16(18,19)12-8-9-14(20-11-12)15-7-4-10-21(15)13-5-2-1-3-6-13;1-13-9-10-15(17-12-13)16-8-5-11-18(16)14-6-3-2-4-7-14;1-2-7-13(8-3-1)17-12-6-10-15(17)14-9-4-5-11-16-14;1-12(2,3)11-14-8-10(15-11)9-6-4-5-7-13-9;1-10(2,3)8(12)7-9(13)11(4,5)6;1-2-13-8-11-7-10(13)9-5-3-4-6-12-9;1-8-5-6-10(12-8)9-4-2-3-7-11-9;8-6(9)5-3-1-2-4-7-5;1-4(6)3-5(2)7;;;;;;/h1-6,8-11H;2-7,9-12H,1H3;1-9,11-12H;4-7H,1-3H3;7,12H,1-6H3;3-6,8H,2H2,1H3;2-5,7H,1H3;1-4H,(H,8,9);3,6H,1-2H3;;;;;;/q4*-1;;2*-1;;;;;;;;.

What are the key properties of 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid?

2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid has a molecular weight of 2835.13 g/mol, XLogP of 23.29, 13 rotatable bonds, 3 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-tert-butyl-5-pyridin-2-yl-4H-1,3-oxazol-4-ide;2-(1-ethyl-4H-imidazol-4-id-5-yl)pyridine;4-hydroxypent-3-en-2-one;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;pentakis(iridium);2-(5-methyl-3H-furan-3-id-2-yl)pyridine;5-methyl-2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)pyridine;2-(1-phenyl-3H-pyrrol-3-id-2-yl)-5-(trifluoromethyl)pyridine;platinum;pyridine-2-carboxylic acid is sourced from PubChem (CID 160806251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).