2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline

C25H15N3O — CID 121340944

IUPAC2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline
SMILESc1ccc(-c2ccc(-c3ccc4oc5nc6ccccc6cc5c4c3)cn2)nc1
InChIInChI=1S/C25H15N3O/c1-2-6-21-17(5-1)14-20-19-13-16(9-11-24(19)29-25(20)28-21)18-8-10-23(27-15-18)22-7-3-4-12-26-22/h1-15H
InChIKeyLEPVTYKAUKCSHU-UHFFFAOYSA-N
MW373.42 g/mol
LogP6.26
Rot. Bonds2

About 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline

2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline (PubChem CID 121340944) has the molecular formula C25H15N3O and a molecular weight of 373.42 g/mol. Its IUPAC name is 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline.

Molecular Properties

Compound Name2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline
PubChem CID121340944
Molecular FormulaC25H15N3O
Molecular Weight373.42 g/mol
Exact Mass373.12
IUPAC Name2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline
SMILESc1ccc(-c2ccc(-c3ccc4oc5nc6ccccc6cc5c4c3)cn2)nc1
InChIInChI=1S/C25H15N3O/c1-2-6-21-17(5-1)14-20-19-13-16(9-11-24(19)29-25(20)28-21)18-8-10-23(27-15-18)22-7-3-4-12-26-22/h1-15H
InChIKeyLEPVTYKAUKCSHU-UHFFFAOYSA-N
XLogP6.26
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.42
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-phenylphenyl)-[1]benzofuro[2,3-b]quinoline
CID 159518374
N-[4-([1]benzofuro[2,3-b]quinolin-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 121340920
8-(6-pyridin-2-yl-3-pyridinyl)-4-[4-[8-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[3,2-b]pyridin-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
CID 142336319
2-[3-([1]benzofuro[2,3-b]quinolin-2-yl)-5-[6-phenyl-2-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]quinoline
CID 121340985
6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine
CID 176818950
2-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)-1,3-diazinan-4-yl]phenyl]-[1]benzofuro[2,3-b]quinoline
CID 163997815
13-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]-17-oxa-2,14-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11,13,15-octaene
CID 121340883
2-[4-(6-dibenzofuran-2-ylnaphthalen-2-yl)phenyl]pyridine
CID 171056233
5-anthracen-1-yl-2-pyridin-2-ylpyridine
CID 58813785
6-pyridin-2-yl-[1]benzofuro[2,3-c]pyridine
CID 90140834
6-[4-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]phenyl]-[1]benzofuro[3,2-c]quinoline
CID 164816907
[4-[7-[6-([1]benzofuro[2,3-b]pyridin-6-yl)-3-pyridinyl]naphthalen-2-yl]phenyl]-trimethylsilane
CID 169294079

Frequently Asked Questions

What is the IUPAC name of 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline?
The IUPAC name of 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline (CID 121340944) is 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline.
What is the SMILES notation for 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline?
The canonical SMILES for 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline is c1ccc(-c2ccc(-c3ccc4oc5nc6ccccc6cc5c4c3)cn2)nc1.
What is the InChIKey of 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline?
The InChIKey is LEPVTYKAUKCSHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H15N3O/c1-2-6-21-17(5-1)14-20-19-13-16(9-11-24(19)29-25(20)28-21)18-8-10-23(27-15-18)22-7-3-4-12-26-22/h1-15H.
What are the key properties of 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline?
2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline has a molecular weight of 373.42 g/mol, XLogP of 6.26, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-pyridin-2-yl-3-pyridinyl)-[1]benzofuro[2,3-b]quinoline is sourced from PubChem (CID 121340944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).