2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)

C84H76N8O12Pt4-4 — CID 159997689

IUPAC2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)
SMILESCC(C)Oc1ccc[c-]c1-c1ccccn1.CCOc1ccc[c-]c1-c1ccccn1.COc1ccc[c-]c1-c1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.[Pt].[Pt].[Pt].[Pt].[c-]1cccc(Oc2ccccc2)c1-c1ccccn1
InChIInChI=1S/C17H12NO.C14H14NO.C13H12NO.C12H10NO.4C7H7NO2.4Pt/c1-2-8-14(9-3-1)19-17-12-5-4-10-15(17)16-11-6-7-13-18-16;1-11(2)16-14-9-4-3-7-12(14)13-8-5-6-10-15-13;1-2-15-13-9-4-3-7-11(13)12-8-5-6-10-14-12;1-14-12-8-3-2-6-10(12)11-7-4-5-9-13-11;4*9-7(10)5-6-3-1-2-4-8-6;;;;/h1-9,11-13H;3-6,8-11H,1-2H3;3-6,8-10H,2H2,1H3;2-5,7-9H,1H3;4*1-4H,5H2,(H,9,10);;;;/q4*-1;;;;;;;;
InChIKeyKWPVBRAUQFTGBX-UHFFFAOYSA-N
MW2169.89 g/mol
LogP16.01
Rot. Bonds19

About 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)

2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid) (PubChem CID 159997689) has the molecular formula C84H76N8O12Pt4-4 and a molecular weight of 2169.89 g/mol. Its IUPAC name is 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid).

Molecular Properties

Compound Name2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)
PubChem CID159997689
Molecular FormulaC84H76N8O12Pt4-4
Molecular Weight2169.89 g/mol
Exact Mass2168.42
IUPAC Name2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)
SMILESCC(C)Oc1ccc[c-]c1-c1ccccn1.CCOc1ccc[c-]c1-c1ccccn1.COc1ccc[c-]c1-c1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.[Pt].[Pt].[Pt].[Pt].[c-]1cccc(Oc2ccccc2)c1-c1ccccn1
InChIInChI=1S/C17H12NO.C14H14NO.C13H12NO.C12H10NO.4C7H7NO2.4Pt/c1-2-8-14(9-3-1)19-17-12-5-4-10-15(17)16-11-6-7-13-18-16;1-11(2)16-14-9-4-3-7-12(14)13-8-5-6-10-15-13;1-2-15-13-9-4-3-7-11(13)12-8-5-6-10-14-12;1-14-12-8-3-2-6-10(12)11-7-4-5-9-13-11;4*9-7(10)5-6-3-1-2-4-8-6;;;;/h1-9,11-13H;3-6,8-11H,1-2H3;3-6,8-10H,2H2,1H3;2-5,7-9H,1H3;4*1-4H,5H2,(H,9,10);;;;/q4*-1;;;;;;;;
InChIKeyKWPVBRAUQFTGBX-UHFFFAOYSA-N
XLogP16.01
TPSA289.24 Ų
H-Bond Donors4
H-Bond Acceptors16
Rotatable Bonds19
Heavy Atoms108
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002169.89
LogP ≤ 516.01
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)?
The IUPAC name of 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid) (CID 159997689) is 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid).
What is the SMILES notation for 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)?
The canonical SMILES for 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid) is CC(C)Oc1ccc[c-]c1-c1ccccn1.CCOc1ccc[c-]c1-c1ccccn1.COc1ccc[c-]c1-c1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.O=C(O)Cc1ccccn1.[Pt].[Pt].[Pt].[Pt].[c-]1cccc(Oc2ccccc2)c1-c1ccccn1.
What is the InChIKey of 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)?
The InChIKey is KWPVBRAUQFTGBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12NO.C14H14NO.C13H12NO.C12H10NO.4C7H7NO2.4Pt/c1-2-8-14(9-3-1)19-17-12-5-4-10-15(17)16-11-6-7-13-18-16;1-11(2)16-14-9-4-3-7-12(14)13-8-5-6-10-15-13;1-2-15-13-9-4-3-7-11(13)12-8-5-6-10-14-12;1-14-12-8-3-2-6-10(12)11-7-4-5-9-13-11;4*9-7(10)5-6-3-1-2-4-8-6;;;;/h1-9,11-13H;3-6,8-11H,1-2H3;3-6,8-10H,2H2,1H3;2-5,7-9H,1H3;4*1-4H,5H2,(H,9,10);;;;/q4*-1;;;;;;;;.
What are the key properties of 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid)?
2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid) has a molecular weight of 2169.89 g/mol, XLogP of 16.01, 19 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxybenzene-6-id-1-yl)pyridine;2-(2-methoxybenzene-6-id-1-yl)pyridine;2-(2-phenoxybenzene-6-id-1-yl)pyridine;platinum;2-(2-propan-2-yloxybenzene-6-id-1-yl)pyridine;tetrakis(2-pyridin-2-ylacetic acid) is sourced from PubChem (CID 159997689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).