3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine

C19H11N3O — CID 168746605

IUPAC3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine
SMILESc1ccc2nnc(-c3cc4c(cn3)oc3ccccc34)cc2c1
InChIInChI=1S/C19H11N3O/c1-3-7-15-12(5-1)9-17(22-21-15)16-10-14-13-6-2-4-8-18(13)23-19(14)11-20-16/h1-11H
InChIKeyPOINMMABDKPNNH-UHFFFAOYSA-N
MW297.32 g/mol
LogP4.59
Rot. Bonds1

About 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine

3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine (PubChem CID 168746605) has the molecular formula C19H11N3O and a molecular weight of 297.32 g/mol. Its IUPAC name is 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine.

Molecular Properties

Compound Name3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine
PubChem CID168746605
Molecular FormulaC19H11N3O
Molecular Weight297.32 g/mol
Exact Mass297.09
IUPAC Name3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine
SMILESc1ccc2nnc(-c3cc4c(cn3)oc3ccccc34)cc2c1
InChIInChI=1S/C19H11N3O/c1-3-7-15-12(5-1)9-17(22-21-15)16-10-14-13-6-2-4-8-18(13)23-19(14)11-20-16/h1-11H
InChIKeyPOINMMABDKPNNH-UHFFFAOYSA-N
XLogP4.59
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)quinolin-2-yl]-[1]benzofuro[2,3-c]pyridine
CID 168746066
3-cinnolin-3-ylcinnoline
CID 12908797
3-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinazolin-4-yl]-[1]benzofuro[2,3-c]pyridine
CID 168745917
3-(3,5-dimethylphenyl)-[1]benzofuro[2,3-c]pyridine
CID 140577687
3-[3-(3-cinnolin-3-yl-5-dibenzofuran-3-ylphenyl)phenyl]-1,10-phenanthroline
CID 171459837
3-([1]benzofuro[2,3-c]pyridin-3-yl)-N-[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]-N-(2-methylpropyl)aniline
CID 140881709
6-(5-dibenzofuran-2-yl-2-pyridinyl)phenanthridine
CID 176818950
3-([1]benzofuro[2,3-c]pyridin-3-yl)-2-fluorobenzenethiol
CID 67326004
N-[4-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]-N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(8-phenyl-1,7-naphthyridin-6-yl)aniline
CID 171463430
4-dibenzofuran-4-yl-8,16-dioxa-5-azatetracyclo[7.7.0.02,7.010,15]hexadeca-1(9),2,4,6,10,12,14-heptaene
CID 162500362
N-[4-([1]benzofuro[3,2-c]pyridin-3-yl)phenyl]-4-quinolin-2-yl-N-(4-quinolin-2-ylphenyl)aniline
CID 168765879
12,22-dioxahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene
CID 118151066

Frequently Asked Questions

What is the IUPAC name of 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine?
The IUPAC name of 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine (CID 168746605) is 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine.
What is the SMILES notation for 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine?
The canonical SMILES for 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine is c1ccc2nnc(-c3cc4c(cn3)oc3ccccc34)cc2c1.
What is the InChIKey of 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine?
The InChIKey is POINMMABDKPNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11N3O/c1-3-7-15-12(5-1)9-17(22-21-15)16-10-14-13-6-2-4-8-18(13)23-19(14)11-20-16/h1-11H.
What are the key properties of 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine?
3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine has a molecular weight of 297.32 g/mol, XLogP of 4.59, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cinnolin-3-yl-[1]benzofuro[2,3-c]pyridine is sourced from PubChem (CID 168746605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).