10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one

C114H78DyEuF8Ir2N15O8PtSTb-3 — CID 157430916

About 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one

10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one (PubChem CID 157430916) has the molecular formula C114H78DyEuF8Ir2N15O8PtSTb-3 and a molecular weight of 3022.93 g/mol. Its IUPAC name is 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one.

Molecular Properties

• Compound Name: 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one
• PubChem CID: 157430916
• Molecular Formula: C114H78DyEuF8Ir2N15O8PtSTb-3
• Molecular Weight: 3022.93 g/mol
• Exact Mass: 3025.24
• IUPAC Name: 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one
• SMILES: CC(=O)C=C(C)O.O=C(C=C(O)c1ccccc1)C(F)(F)F.O=C(C=C(O)c1cccs1)C(F)(F)F.O=C(O)c1ccccn1.[C-]#[N+]c1c(F)c[c-]c(-c2ccccn2)c1F.[Dy].[Eu].[Ir].[Ir].[Pt+2].[Tb].[c-]1c(-c2ccccn2)cncc1-c1ccccn1.[c-]1cc2ccccc2cc1-c1nccc2ccccc12.[c-]1cccc2ccc3cccnc3c12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1nc[n-]n1
• InChI: InChI=1S/C19H12N.C15H10N3.C13H8N.C12H5F2N2.2C12H8N2.C10H7F3O2.C8H5F3O2S.C6H5NO2.C5H8O2.C2H2N3.Dy.Eu.2Ir.Pt.Tb/c1-2-7-16-13-17(10-9-14(16)5-1)19-18-8-4-3-6-15(18)11-12-20-19;1-3-7-17-14(5-1)12-9-13(11-16-10-12)15-6-2-4-8-18-15;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;1-15-12-9(13)6-5-8(11(12)14)10-4-2-3-7-16-10;2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7;9-8(10,11)7(13)4-5(12)6-2-1-3-14-6;8-6(9)5-3-1-2-4-7-5;1-4(6)3-5(2)7;1-3-2-5-4-1;;;;;;/h1-9,11-13H;1-8,10-11H;1-5,7-9H;2-4,6-7H;2*1-8H;1-6,14H;1-4,12H;1-4H,(H,8,9);3,6H,1-2H3;1-2H;;;;;;/q4*-1;;;;;;;-1;;;;;+2
• InChIKey: VFHQZPHMVCICQE-UHFFFAOYSA-N
• XLogP: 26.73
• TPSA: 335.23 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 10
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3022.93
LogP ≤ 5	26.73
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

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'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one?

The IUPAC name of 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one (CID 157430916) is 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one.

What is the SMILES notation for 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one?

The canonical SMILES for 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one is CC(=O)C=C(C)O.O=C(C=C(O)c1ccccc1)C(F)(F)F.O=C(C=C(O)c1cccs1)C(F)(F)F.O=C(O)c1ccccn1.[C-]#[N+]c1c(F)c[c-]c(-c2ccccn2)c1F.[Dy].[Eu].[Ir].[Ir].[Pt+2].[Tb].[c-]1c(-c2ccccn2)cncc1-c1ccccn1.[c-]1cc2ccccc2cc1-c1nccc2ccccc12.[c-]1cccc2ccc3cccnc3c12.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12.c1nc[n-]n1.

What is the InChIKey of 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one?

The InChIKey is VFHQZPHMVCICQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N.C15H10N3.C13H8N.C12H5F2N2.2C12H8N2.C10H7F3O2.C8H5F3O2S.C6H5NO2.C5H8O2.C2H2N3.Dy.Eu.2Ir.Pt.Tb/c1-2-7-16-13-17(10-9-14(16)5-1)19-18-8-4-3-6-15(18)11-12-20-19;1-3-7-17-14(5-1)12-9-13(11-16-10-12)15-6-2-4-8-18-15;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;1-15-12-9(13)6-5-8(11(12)14)10-4-2-3-7-16-10;2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7;9-8(10,11)7(13)4-5(12)6-2-1-3-14-6;8-6(9)5-3-1-2-4-7-5;1-4(6)3-5(2)7;1-3-2-5-4-1;;;;;;/h1-9,11-13H;1-8,10-11H;1-5,7-9H;2-4,6-7H;2*1-8H;1-6,14H;1-4,12H;1-4H,(H,8,9);3,6H,1-2H3;1-2H;;;;;;/q4*-1;;;;;;;-1;;;;;+2;.

What are the key properties of 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one?

10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one has a molecular weight of 3022.93 g/mol, XLogP of 26.73, 10 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 10H-benzo[h]quinolin-10-ide;2,4-diaza-1-azanidacyclopenta-2,4-diene;2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;3,5-dipyridin-2-yl-4H-pyridin-4-ide;dysprosium;europium;4-hydroxypent-3-en-2-one;bis(iridium);1-(3H-naphthalen-3-id-2-yl)isoquinoline;bis(1,10-phenanthroline);platinum(2+);pyridine-2-carboxylic acid;terbium;1,1,1-trifluoro-4-hydroxy-4-phenylbut-3-en-2-one;1,1,1-trifluoro-4-hydroxy-4-thiophen-2-ylbut-3-en-2-one is sourced from PubChem (CID 157430916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).