4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine

C22H12N2O2 — CID 142281054

IUPAC4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine
SMILESc1ccc2c(c1)oc1c(-c3ccnc4c3oc3ccccc34)ccnc12
InChIInChI=1S/C22H12N2O2/c1-3-7-17-15(5-1)19-21(25-17)13(9-11-23-19)14-10-12-24-20-16-6-2-4-8-18(16)26-22(14)20/h1-12H
InChIKeyZUTSHPWQCHNYPP-UHFFFAOYSA-N
MW336.35 g/mol
LogP5.94
Rot. Bonds1

About 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine

4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine (PubChem CID 142281054) has the molecular formula C22H12N2O2 and a molecular weight of 336.35 g/mol. Its IUPAC name is 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine.

Molecular Properties

Compound Name4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine
PubChem CID142281054
Molecular FormulaC22H12N2O2
Molecular Weight336.35 g/mol
Exact Mass336.09
IUPAC Name4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine
SMILESc1ccc2c(c1)oc1c(-c3ccnc4c3oc3ccccc34)ccnc12
InChIInChI=1S/C22H12N2O2/c1-3-7-17-15(5-1)19-21(25-17)13(9-11-23-19)14-10-12-24-20-16-6-2-4-8-18(16)26-22(14)20/h1-12H
InChIKeyZUTSHPWQCHNYPP-UHFFFAOYSA-N
XLogP5.94
TPSA52.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.35
LogP ≤ 55.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-phenyl-[1]benzofuro[3,2-b]pyridine
CID 90139239
4,8-bis([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine
CID 130191509
4-[3-([1]benzofuro[3,2-b]pyridin-4-yl)-5-[4-([1]benzofuro[3,2-b]pyridin-4-yl)phenyl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336336
4-[4-([1]benzofuro[3,2-b]pyridin-4-yl)naphthalen-1-yl]-8-fluoro-[1]benzofuro[3,2-b]pyridine
CID 142336489
4-[8-([1]benzofuro[3,2-b]pyridin-4-yl)-9-phenylcarbazol-1-yl]-[1]benzofuro[3,2-b]pyridine
CID 142336434
4-[3-[4-([1]benzofuro[3,2-b]pyridin-4-yl)phenyl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336353
8-([1]benzofuro[3,2-b]pyridin-2-yl)-4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine
CID 153311745
4-([1]benzofuro[3,2-b]pyridin-4-yl)-N,N-bis(4-triphenylen-1-ylphenyl)aniline
CID 168765389
4-[3-([1]benzofuro[3,2-b]pyridin-4-yl)-5-pyridin-4-ylphenyl]-8-pyridin-4-yl-[1]benzofuro[3,2-b]pyridine
CID 142336447
4-[3-([1]benzofuro[3,2-b]pyridin-4-yl)-5-(2,6-diphenylpyrimidin-4-yl)phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336371
[1]benzofuro[3,2-b]pyridin-4-yl(triphenyl)silane
CID 123936384
[1]benzofuro[2,3-b]pyrazine
CID 55297119

Frequently Asked Questions

What is the IUPAC name of 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine?
The IUPAC name of 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine (CID 142281054) is 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine.
What is the SMILES notation for 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine?
The canonical SMILES for 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine is c1ccc2c(c1)oc1c(-c3ccnc4c3oc3ccccc34)ccnc12.
What is the InChIKey of 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine?
The InChIKey is ZUTSHPWQCHNYPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H12N2O2/c1-3-7-17-15(5-1)19-21(25-17)13(9-11-23-19)14-10-12-24-20-16-6-2-4-8-18(16)26-22(14)20/h1-12H.
What are the key properties of 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine?
4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine has a molecular weight of 336.35 g/mol, XLogP of 5.94, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-([1]benzofuro[3,2-b]pyridin-4-yl)-[1]benzofuro[3,2-b]pyridine is sourced from PubChem (CID 142281054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).