2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine

C31H19N3O2 — CID 139043734

IUPAC2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine
SMILESc1ccc(-c2cc3cc(-c4cccc(-c5cc6cc(-c7ccccc7)oc6cn5)n4)ncc3o2)cc1
InChIInChI=1S/C31H19N3O2/c1-3-8-20(9-4-1)28-16-22-14-26(32-18-30(22)35-28)24-12-7-13-25(34-24)27-15-23-17-29(36-31(23)19-33-27)21-10-5-2-6-11-21/h1-19H
InChIKeyJKADYBUEBSERJI-UHFFFAOYSA-N
MW465.51 g/mol
LogP8.03
Rot. Bonds4

About 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine

2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine (PubChem CID 139043734) has the molecular formula C31H19N3O2 and a molecular weight of 465.51 g/mol. Its IUPAC name is 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine.

Molecular Properties

Compound Name2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine
PubChem CID139043734
Molecular FormulaC31H19N3O2
Molecular Weight465.51 g/mol
Exact Mass465.15
IUPAC Name2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine
SMILESc1ccc(-c2cc3cc(-c4cccc(-c5cc6cc(-c7ccccc7)oc6cn5)n4)ncc3o2)cc1
InChIInChI=1S/C31H19N3O2/c1-3-8-20(9-4-1)28-16-22-14-26(32-18-30(22)35-28)24-12-7-13-25(34-24)27-15-23-17-29(36-31(23)19-33-27)21-10-5-2-6-11-21/h1-19H
InChIKeyJKADYBUEBSERJI-UHFFFAOYSA-N
XLogP8.03
TPSA64.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500465.51
LogP ≤ 58.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine?
The IUPAC name of 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine (CID 139043734) is 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine.
What is the SMILES notation for 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine?
The canonical SMILES for 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine is c1ccc(-c2cc3cc(-c4cccc(-c5cc6cc(-c7ccccc7)oc6cn5)n4)ncc3o2)cc1.
What is the InChIKey of 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine?
The InChIKey is JKADYBUEBSERJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H19N3O2/c1-3-8-20(9-4-1)28-16-22-14-26(32-18-30(22)35-28)24-12-7-13-25(34-24)27-15-23-17-29(36-31(23)19-33-27)21-10-5-2-6-11-21/h1-19H.
What are the key properties of 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine?
2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine has a molecular weight of 465.51 g/mol, XLogP of 8.03, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-[6-(2-phenylfuro[2,3-c]pyridin-5-yl)-2-pyridinyl]furo[2,3-c]pyridine is sourced from PubChem (CID 139043734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).