4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten

C134H107F6N15O2W6-6 — CID 160967945

About 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten

4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten (PubChem CID 160967945) has the molecular formula C134H107F6N15O2W6-6 and a molecular weight of 3176.46 g/mol. Its IUPAC name is 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten.

Molecular Properties

• Compound Name: 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten
• PubChem CID: 160967945
• Molecular Formula: C134H107F6N15O2W6-6
• Molecular Weight: 3176.46 g/mol
• Exact Mass: 3175.57
• IUPAC Name: 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten
• SMILES: C#Cc1c[c-]cc(C#N)c1.Cc1[c-]nc2c(ccc3cccnc32)c1.Cc1cc(-c2ccccc2)c[c-]n1.Cc1ccc(-c2ccccc2)cn1.Cc1ccc(-c2ccccc2)nc1.Cc1ccc(C(=O)C(F)(F)F)cc1.Cc1ccc2nc(C)cnc2c1.Cc1cccc(C(=O)C(F)(F)F)c1.Cc1ccnc2c1c(C)cc1cccnc12.Cc1ccnc2c1ccc1c(C)ccnc12.Cc1ncc2c[c-]ccc2n1.[W].[W].[W].[W].[W].[W].[c-]1cc(-c2ccccc2)c[c-]n1
• InChI: InChI=1S/2C14H12N2.C13H9N2.C12H10N.2C12H11N.C11H7N.C10H10N2.2C9H7F3O.C9H7N2.C9H4N.6W/c1-9-5-7-15-13-11(9)3-4-12-10(2)6-8-16-14(12)13;1-9-5-7-16-14-12(9)10(2)8-11-4-3-6-15-13(11)14;1-9-7-11-5-4-10-3-2-6-14-12(10)13(11)15-8-9;1-10-9-12(7-8-13-10)11-5-3-2-4-6-11;1-10-7-8-12(9-13-10)11-5-3-2-4-6-11;1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;1-2-4-10(5-3-1)11-6-8-12-9-7-11;1-7-3-4-9-10(5-7)11-6-8(2)12-9;1-6-2-4-7(5-3-6)8(13)9(10,11)12;1-6-3-2-4-7(5-6)8(13)9(10,11)12;1-7-10-6-8-4-2-3-5-9(8)11-7;1-2-8-4-3-5-9(6-8)7-10;;;;;;/h2*3-8H,1-2H3;2-7H,1H3;2-7,9H,1H3;2*2-9H,1H3;1-7H;3-6H,1-2H3;2*2-5H,1H3;3-6H,1H3;1,4-6H;;;;;;/q;;2*-1;;;-2;;;;2*-1
• InChIKey: QMVILPKYBDTJNE-UHFFFAOYSA-N
• XLogP: 31.80
• TPSA: 238.39 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 6
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3176.46
LogP ≤ 5	31.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten?

The IUPAC name of 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten (CID 160967945) is 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten.

What is the SMILES notation for 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten?

The canonical SMILES for 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten is C#Cc1c[c-]cc(C#N)c1.Cc1[c-]nc2c(ccc3cccnc32)c1.Cc1cc(-c2ccccc2)c[c-]n1.Cc1ccc(-c2ccccc2)cn1.Cc1ccc(-c2ccccc2)nc1.Cc1ccc(C(=O)C(F)(F)F)cc1.Cc1ccc2nc(C)cnc2c1.Cc1cccc(C(=O)C(F)(F)F)c1.Cc1ccnc2c1c(C)cc1cccnc12.Cc1ccnc2c1ccc1c(C)ccnc12.Cc1ncc2c[c-]ccc2n1.[W].[W].[W].[W].[W].[W].[c-]1cc(-c2ccccc2)c[c-]n1.

What is the InChIKey of 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten?

The InChIKey is QMVILPKYBDTJNE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H12N2.C13H9N2.C12H10N.2C12H11N.C11H7N.C10H10N2.2C9H7F3O.C9H7N2.C9H4N.6W/c1-9-5-7-15-13-11(9)3-4-12-10(2)6-8-16-14(12)13;1-9-5-7-16-14-12(9)10(2)8-11-4-3-6-15-13(11)14;1-9-7-11-5-4-10-3-2-6-14-12(10)13(11)15-8-9;1-10-9-12(7-8-13-10)11-5-3-2-4-6-11;1-10-7-8-12(9-13-10)11-5-3-2-4-6-11;1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;1-2-4-10(5-3-1)11-6-8-12-9-7-11;1-7-3-4-9-10(5-7)11-6-8(2)12-9;1-6-2-4-7(5-3-6)8(13)9(10,11)12;1-6-3-2-4-7(5-6)8(13)9(10,11)12;1-7-10-6-8-4-2-3-5-9(8)11-7;1-2-8-4-3-5-9(6-8)7-10;;;;;;/h2*3-8H,1-2H3;2-7H,1H3;2-7,9H,1H3;2*2-9H,1H3;1-7H;3-6H,1-2H3;2*2-5H,1H3;3-6H,1H3;1,4-6H;;;;;;/q;;2*-1;;;-2;;;;2*-1;;;;;;.

What are the key properties of 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten?

4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten has a molecular weight of 3176.46 g/mol, XLogP of 31.80, 6 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 4,5-dimethyl-1,10-phenanthroline;4,7-dimethyl-1,10-phenanthroline;2,6-dimethylquinoxaline;3-ethynylbenzene-5-ide-1-carbonitrile;3-methyl-2H-1,10-phenanthrolin-2-ide;2-methyl-5-phenylpyridine;5-methyl-2-phenylpyridine;6-methyl-4-phenyl-2H-pyridin-2-ide;2-methyl-6H-quinazolin-6-ide;4-phenyl-2,6-dihydropyridine-2,6-diide;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;tungsten is sourced from PubChem (CID 160967945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).