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

C30H18N8O2 — CID 59236802

IUPAC2-(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
SMILESc1ccc(-c2cccc(-c3nnc(-c4ccc(-c5nnc(-c6cccc(-c7ccccn7)n6)o5)cc4)o3)n2)nc1
InChIInChI=1S/C30H18N8O2/c1-3-17-31-21(7-1)23-9-5-11-25(33-23)29-37-35-27(39-29)19-13-15-20(16-14-19)28-36-38-30(40-28)26-12-6-10-24(34-26)22-8-2-4-18-32-22/h1-18H
InChIKeyDVKIARPWIBRUJL-UHFFFAOYSA-N
MW522.53 g/mol
LogP6.03
Rot. Bonds6

About 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

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 (PubChem CID 59236802) has the molecular formula C30H18N8O2 and a molecular weight of 522.53 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-(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
PubChem CID59236802
Molecular FormulaC30H18N8O2
Molecular Weight522.53 g/mol
Exact Mass522.16
IUPAC Name2-(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
SMILESc1ccc(-c2cccc(-c3nnc(-c4ccc(-c5nnc(-c6cccc(-c7ccccn7)n6)o5)cc4)o3)n2)nc1
InChIInChI=1S/C30H18N8O2/c1-3-17-31-21(7-1)23-9-5-11-25(33-23)29-37-35-27(39-29)19-13-15-20(16-14-19)28-36-38-30(40-28)26-12-6-10-24(34-26)22-8-2-4-18-32-22/h1-18H
InChIKeyDVKIARPWIBRUJL-UHFFFAOYSA-N
XLogP6.03
TPSA129.40 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500522.53
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-c2cccc(-c3nnc(-c4ccc(-c5nnc(-c6cccc(-c7ccccn7)n6)o5)cc4)o3)n2)nc1.
What is the InChIKey of 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?
The InChIKey is DVKIARPWIBRUJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H18N8O2/c1-3-17-31-21(7-1)23-9-5-11-25(33-23)29-37-35-27(39-29)19-13-15-20(16-14-19)28-36-38-30(40-28)26-12-6-10-24(34-26)22-8-2-4-18-32-22/h1-18H.
What are the key properties of 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?
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 has a molecular weight of 522.53 g/mol, XLogP of 6.03, 6 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 59236802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).