2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole

C36H20N10O2 — CID 175973824

IUPAC2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole
SMILESc1ccc(-c2cccc(-c3nnc(-c4ccc5ccc6c(-c7nnc(-c8cccc(-c9ccccn9)n8)o7)ccnc6c5n4)o3)n2)nc1
InChIInChI=1S/C36H20N10O2/c1-3-18-37-24(7-1)26-9-5-11-28(40-26)34-44-43-33(47-34)23-17-20-39-32-22(23)15-13-21-14-16-30(42-31(21)32)36-46-45-35(48-36)29-12-6-10-27(41-29)25-8-2-4-19-38-25/h1-20H
InChIKeyOZODJZQZIHOKST-UHFFFAOYSA-N
MW624.62 g/mol
LogP7.13
Rot. Bonds6

About 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole

2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole (PubChem CID 175973824) has the molecular formula C36H20N10O2 and a molecular weight of 624.62 g/mol. Its IUPAC name is 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole
PubChem CID175973824
Molecular FormulaC36H20N10O2
Molecular Weight624.62 g/mol
Exact Mass624.18
IUPAC Name2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole
SMILESc1ccc(-c2cccc(-c3nnc(-c4ccc5ccc6c(-c7nnc(-c8cccc(-c9ccccn9)n8)o7)ccnc6c5n4)o3)n2)nc1
InChIInChI=1S/C36H20N10O2/c1-3-18-37-24(7-1)26-9-5-11-28(40-26)34-44-43-33(47-34)23-17-20-39-32-22(23)15-13-21-14-16-30(42-31(21)32)36-46-45-35(48-36)29-12-6-10-27(41-29)25-8-2-4-19-38-25/h1-20H
InChIKeyOZODJZQZIHOKST-UHFFFAOYSA-N
XLogP7.13
TPSA155.18 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500624.62
LogP ≤ 57.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole with MolForge

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Launch Full Analysis

Related Compounds

2-(6-pyridin-2-yl-2-pyridinyl)-5-[6-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-1,3,4-oxadiazole
CID 59514881
2-(6-pyridin-2-yl-2-pyridinyl)-5-[4-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 59236802
1,10-phenanthroline;2-pyridin-2-ylpyridine;2-quinolin-2-ylquinoline;ruthenium(2+)
CID 138986830
3-(1,10-phenanthrolin-2-yl)-[1,2,4]triazino[6,5-f][1,10]phenanthroline;bis(2-pyridin-2-ylpyridine);ruthenium(2+);diperchlorate
CID 11193998
2-(4-dibenzofuran-4-ylphenyl)-9-pyridin-2-yl-1,10-phenanthroline
CID 90049857
2-[6-pyridin-2-yl-4-[(2-pyridin-2-yl-4-pyridinyl)methyl]-2-pyridinyl]-1,10-phenanthroline
CID 158270665
2-chloro-9-pyridin-2-yl-1,10-phenanthroline
CID 170902643
platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride
CID 71543302
5-(4-dibenzofuran-4-ylphenyl)-2,9-dipyridin-2-yl-1,10-phenanthroline
CID 90050350
2-[6-[2-[3-(1,10-phenanthrolin-2-yl)phenyl]quinolin-6-yl]quinolin-2-yl]-9-phenyl-1,10-phenanthroline;2-[4-[6-[2-(1,10-phenanthrolin-4-yl)quinolin-6-yl]quinolin-2-yl]phenyl]-1,10-phenanthroline
CID 161400463
2-pyridin-2-yl-9-(3-triphenylen-2-ylphenyl)-1,10-phenanthroline
CID 134167567
4,7-bis(6-phenyl-2-pyridinyl)-1,10-phenanthroline
CID 121420323

Frequently Asked Questions

What is the IUPAC name of 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole?
The IUPAC name of 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole (CID 175973824) is 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole?
The canonical SMILES for 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole is c1ccc(-c2cccc(-c3nnc(-c4ccc5ccc6c(-c7nnc(-c8cccc(-c9ccccn9)n8)o7)ccnc6c5n4)o3)n2)nc1.
What is the InChIKey of 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole?
The InChIKey is OZODJZQZIHOKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H20N10O2/c1-3-18-37-24(7-1)26-9-5-11-28(40-26)34-44-43-33(47-34)23-17-20-39-32-22(23)15-13-21-14-16-30(42-31(21)32)36-46-45-35(48-36)29-12-6-10-27(41-29)25-8-2-4-19-38-25/h1-20H.
What are the key properties of 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole?
2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole has a molecular weight of 624.62 g/mol, XLogP of 7.13, 6 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-pyridin-2-yl-2-pyridinyl)-5-[7-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-1,10-phenanthrolin-2-yl]-1,3,4-oxadiazole is sourced from PubChem (CID 175973824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).