bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid)

C124H110F6Ir4N20O20-8 — CID 157304481

About bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid)

bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid) (PubChem CID 157304481) has the molecular formula C124H110F6Ir4N20O20-8 and a molecular weight of 3083.22 g/mol. Its IUPAC name is bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid).

Molecular Properties

• Compound Name: bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid)
• PubChem CID: 157304481
• Molecular Formula: C124H110F6Ir4N20O20-8
• Molecular Weight: 3083.22 g/mol
• Exact Mass: 3084.67
• IUPAC Name: bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid)
• SMILES: COc1c[c-]c(-c2cc(C)ccn2)c(C)n1.COc1c[c-]c(-c2cc(C)ccn2)c(C)n1.COc1c[c-]c(-c2ccc(C(F)(F)F)cn2)c(OC)n1.COc1c[c-]c(-c2ccc(C(F)(F)F)cn2)c(OC)n1.COc1c[c-]c(-c2ccccn2)c(C)n1.COc1c[c-]c(-c2ccccn2)c(C)n1.COc1c[c-]c(-c2ccccn2)c(OC)n1.COc1c[c-]c(-c2ccccn2)c(OC)n1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/2C13H10F3N2O2.2C13H13N2O.2C12H11N2O2.2C12H11N2O.4C6H5NO2.4Ir/c2*1-19-11-6-4-9(12(18-11)20-2)10-5-3-8(7-17-10)13(14,15)16;2*1-9-6-7-14-12(8-9)11-4-5-13(16-3)15-10(11)2;2*1-15-11-7-6-9(12(14-11)16-2)10-5-3-4-8-13-10;2*1-9-10(6-7-12(14-9)15-2)11-5-3-4-8-13-11;4*8-6(9)5-3-1-2-4-7-5;;;;/h2*3,5-7H,1-2H3;2*5-8H,1-3H3;2*3-5,7-8H,1-2H3;2*3-5,7-8H,1-2H3;4*1-4H,(H,8,9);;;;/q8*-1
• InChIKey: MYZMSNLWSNVCND-UHFFFAOYSA-N
• XLogP: 22.65
• TPSA: 517.76 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 36
• Rotatable Bonds: 24
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3083.22
LogP ≤ 5	22.65
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid)?

The IUPAC name of bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid) (CID 157304481) is bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid).

What is the SMILES notation for bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid)?

The canonical SMILES for bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid) is COc1c[c-]c(-c2cc(C)ccn2)c(C)n1.COc1c[c-]c(-c2cc(C)ccn2)c(C)n1.COc1c[c-]c(-c2ccc(C(F)(F)F)cn2)c(OC)n1.COc1c[c-]c(-c2ccc(C(F)(F)F)cn2)c(OC)n1.COc1c[c-]c(-c2ccccn2)c(C)n1.COc1c[c-]c(-c2ccccn2)c(C)n1.COc1c[c-]c(-c2ccccn2)c(OC)n1.COc1c[c-]c(-c2ccccn2)c(OC)n1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid)?

The InChIKey is MYZMSNLWSNVCND-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H10F3N2O2.2C13H13N2O.2C12H11N2O2.2C12H11N2O.4C6H5NO2.4Ir/c2*1-19-11-6-4-9(12(18-11)20-2)10-5-3-8(7-17-10)13(14,15)16;2*1-9-6-7-14-12(8-9)11-4-5-13(16-3)15-10(11)2;2*1-15-11-7-6-9(12(14-11)16-2)10-5-3-4-8-13-10;2*1-9-10(6-7-12(14-9)15-2)11-5-3-4-8-13-11;4*8-6(9)5-3-1-2-4-7-5;;;;/h2*3,5-7H,1-2H3;2*5-8H,1-3H3;2*3-5,7-8H,1-2H3;2*3-5,7-8H,1-2H3;4*1-4H,(H,8,9);;;;/q8*-1;;;;;;;;.

What are the key properties of bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid)?

bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid) has a molecular weight of 3083.22 g/mol, XLogP of 22.65, 24 rotatable bonds, 4 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2,6-dimethoxy-3-pyridin-2-yl-4H-pyridin-4-ide);bis(2,6-dimethoxy-3-[5-(trifluoromethyl)-2-pyridinyl]-4H-pyridin-4-ide);tetrakis(iridium);bis(6-methoxy-2-methyl-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide);bis(6-methoxy-2-methyl-3-pyridin-2-yl-4H-pyridin-4-ide);tetrakis(pyridine-2-carboxylic acid) is sourced from PubChem (CID 157304481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).