2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile

C203H117N5O10 — CID 161466472

IUPAC2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile
SMILESN#Cc1cc(-c2ccccc2)cc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1cccc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1cccc(-c2cccc(-c3ccc4oc5ccccc5c4c3)c2-c2ccc3oc4ccccc4c3c2)c1.N#Cc1ccccc1-c1cc(-c2ccccc2)cc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1ccccc1-c1cccc(-c2ccc3oc4ccccc4c3c2)c1-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C49H29NO2.C43H25NO2.3C37H21NO2/c50-30-32-15-4-5-16-36(32)34-27-33(31-13-2-1-3-14-31)28-35(29-34)47-37(39-21-11-25-45-48(39)41-17-6-8-23-43(41)51-45)19-10-20-38(47)40-22-12-26-46-49(40)42-18-7-9-24-44(42)52-46;44-26-27-23-29(28-11-2-1-3-12-28)25-30(24-27)41-31(33-17-9-21-39-42(33)35-13-4-6-19-37(35)45-39)15-8-16-32(41)34-18-10-22-40-43(34)36-14-5-7-20-38(36)46-40;38-22-23-9-5-10-24(21-23)35-25(27-15-7-19-33-36(27)29-11-1-3-17-31(29)39-33)13-6-14-26(35)28-16-8-20-34-37(28)30-12-2-4-18-32(30)40-34;38-22-23-7-5-8-24(19-23)27-11-6-12-28(25-15-17-35-31(20-25)29-9-1-3-13-33(29)39-35)37(27)26-16-18-36-32(21-26)30-10-2-4-14-34(30)40-36;38-22-25-8-1-2-9-26(25)30-13-7-12-27(23-16-18-35-31(20-23)28-10-3-5-14-33(28)39-35)37(30)24-17-19-36-32(21-24)29-11-4-6-15-34(29)40-36/h1-29H;1-25H;3*1-21H
InChIKeyWCMTYNOSHUEVND-UHFFFAOYSA-N
MW2786.19 g/mol
LogP56.79
Rot. Bonds18

About 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile

2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile (PubChem CID 161466472) has the molecular formula C203H117N5O10 and a molecular weight of 2786.19 g/mol. Its IUPAC name is 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile.

Molecular Properties

Compound Name2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile
PubChem CID161466472
Molecular FormulaC203H117N5O10
Molecular Weight2786.19 g/mol
Exact Mass2783.88
IUPAC Name2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile
SMILESN#Cc1cc(-c2ccccc2)cc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1cccc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1cccc(-c2cccc(-c3ccc4oc5ccccc5c4c3)c2-c2ccc3oc4ccccc4c3c2)c1.N#Cc1ccccc1-c1cc(-c2ccccc2)cc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1ccccc1-c1cccc(-c2ccc3oc4ccccc4c3c2)c1-c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C49H29NO2.C43H25NO2.3C37H21NO2/c50-30-32-15-4-5-16-36(32)34-27-33(31-13-2-1-3-14-31)28-35(29-34)47-37(39-21-11-25-45-48(39)41-17-6-8-23-43(41)51-45)19-10-20-38(47)40-22-12-26-46-49(40)42-18-7-9-24-44(42)52-46;44-26-27-23-29(28-11-2-1-3-12-28)25-30(24-27)41-31(33-17-9-21-39-42(33)35-13-4-6-19-37(35)45-39)15-8-16-32(41)34-18-10-22-40-43(34)36-14-5-7-20-38(36)46-40;38-22-23-9-5-10-24(21-23)35-25(27-15-7-19-33-36(27)29-11-1-3-17-31(29)39-33)13-6-14-26(35)28-16-8-20-34-37(28)30-12-2-4-18-32(30)40-34;38-22-23-7-5-8-24(19-23)27-11-6-12-28(25-15-17-35-31(20-25)29-9-1-3-13-33(29)39-35)37(27)26-16-18-36-32(21-26)30-10-2-4-14-34(30)40-36;38-22-25-8-1-2-9-26(25)30-13-7-12-27(23-16-18-35-31(20-23)28-10-3-5-14-33(28)39-35)37(30)24-17-19-36-32(21-24)29-11-4-6-15-34(29)40-36/h1-29H;1-25H;3*1-21H
InChIKeyWCMTYNOSHUEVND-UHFFFAOYSA-N
XLogP56.79
TPSA250.35 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002786.19
LogP ≤ 556.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile with MolForge

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Related Compounds

3-(2-dibenzofuran-1-yl-6-dibenzofuran-2-ylphenyl)benzonitrile
CID 146355352
2-(2-dibenzofuran-1-yl-6-dibenzofuran-2-ylphenyl)benzonitrile
CID 146355346
8-[3-(2-cyanophenyl)-4-dibenzofuran-3-ylphenyl]dibenzofuran-2-carbonitrile;2-(5-dibenzofuran-2-yl-2-dibenzofuran-3-ylphenyl)benzonitrile;3-(5-dibenzofuran-2-yl-2-dibenzofuran-3-ylphenyl)benzonitrile;2-[2-(5-dibenzofuran-2-yl-2-dibenzofuran-3-ylphenyl)phenyl]benzonitrile;3-(5-dibenzofuran-2-yl-2-dibenzofuran-3-ylphenyl)-5-phenylbenzonitrile
CID 157239816
2-[4-[3,5-di(dibenzofuran-2-yl)phenyl]-3,5-diphenylphenyl]benzonitrile
CID 146353689
2-[3-(2-dibenzofuran-2-yl-6-dibenzothiophen-4-ylphenyl)-5-phenylphenyl]benzonitrile
CID 146355085
8-[3-(2-cyano-6-phenylphenyl)-5-dibenzofuran-2-ylphenyl]dibenzofuran-2-carbonitrile
CID 146354419
3-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenylbenzonitrile
CID 146354418
8-[3-(8-cyanodibenzofuran-2-yl)-5-[3-(2-cyanophenyl)phenyl]phenyl]dibenzofuran-2-carbonitrile
CID 146354560
2-(2-cyanophenyl)-4-dibenzofuran-1-yl-6-dibenzofuran-4-ylbenzonitrile;2-(2-cyanophenyl)-6-dibenzofuran-1-yl-4-dibenzofuran-4-ylbenzonitrile;2-(3-cyanophenyl)-6-dibenzofuran-1-yl-4-dibenzofuran-4-ylbenzonitrile;4-(2-cyanophenyl)-2-dibenzofuran-1-yl-6-dibenzofuran-4-ylbenzonitrile;2-(3-dibenzofuran-1-yl-5-dibenzofuran-4-ylphenyl)benzene-1,3-dicarbonitrile
CID 159057722
7-[2-(3-cyanophenyl)-3-dibenzofuran-3-ylphenyl]dibenzofuran-2-carbonitrile
CID 146353959
7-[2-(3-cyanophenyl)-3-dibenzothiophen-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-dibenzofuran-3-yl-6-dibenzothiophen-4-ylphenyl)benzonitrile;3-(2-dibenzofuran-4-yl-6-dibenzothiophen-3-ylphenyl)benzonitrile;3-(2-dibenzofuran-4-yl-6-dibenzothiophen-3-ylphenyl)-5-phenylbenzonitrile;2-[3-(2-dibenzofuran-3-yl-6-dibenzothiophen-3-ylphenyl)-5-phenylphenyl]benzonitrile
CID 159656811
9-[3-[3-(2-cyanophenyl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole-3-carbonitrile;9-[3-[3-(3-cyanophenyl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole-3-carbonitrile;9-[3-[3-(4-cyanophenyl)phenyl]-5-dibenzofuran-2-ylphenyl]carbazole-3-carbonitrile
CID 158987615

Frequently Asked Questions

What is the IUPAC name of 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile?
The IUPAC name of 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile (CID 161466472) is 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile.
What is the SMILES notation for 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile?
The canonical SMILES for 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile is N#Cc1cc(-c2ccccc2)cc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1cccc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1cccc(-c2cccc(-c3ccc4oc5ccccc5c4c3)c2-c2ccc3oc4ccccc4c3c2)c1.N#Cc1ccccc1-c1cc(-c2ccccc2)cc(-c2c(-c3cccc4oc5ccccc5c34)cccc2-c2cccc3oc4ccccc4c23)c1.N#Cc1ccccc1-c1cccc(-c2ccc3oc4ccccc4c3c2)c1-c1ccc2oc3ccccc3c2c1.
What is the InChIKey of 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile?
The InChIKey is WCMTYNOSHUEVND-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H29NO2.C43H25NO2.3C37H21NO2/c50-30-32-15-4-5-16-36(32)34-27-33(31-13-2-1-3-14-31)28-35(29-34)47-37(39-21-11-25-45-48(39)41-17-6-8-23-43(41)51-45)19-10-20-38(47)40-22-12-26-46-49(40)42-18-7-9-24-44(42)52-46;44-26-27-23-29(28-11-2-1-3-12-28)25-30(24-27)41-31(33-17-9-21-39-42(33)35-13-4-6-19-37(35)45-39)15-8-16-32(41)34-18-10-22-40-43(34)36-14-5-7-20-38(36)46-40;38-22-23-9-5-10-24(21-23)35-25(27-15-7-19-33-36(27)29-11-1-3-17-31(29)39-33)13-6-14-26(35)28-16-8-20-34-37(28)30-12-2-4-18-32(30)40-34;38-22-23-7-5-8-24(19-23)27-11-6-12-28(25-15-17-35-31(20-25)29-9-1-3-13-33(29)39-35)37(27)26-16-18-36-32(21-26)30-10-2-4-14-34(30)40-36;38-22-25-8-1-2-9-26(25)30-13-7-12-27(23-16-18-35-31(20-23)28-10-3-5-14-33(28)39-35)37(30)24-17-19-36-32(21-24)29-11-4-6-15-34(29)40-36/h1-29H;1-25H;3*1-21H.
What are the key properties of 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile?
2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile has a molecular weight of 2786.19 g/mol, XLogP of 56.79, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,3-di(dibenzofuran-2-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]benzonitrile;3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylbenzonitrile;2-[3-[2,6-di(dibenzofuran-1-yl)phenyl]-5-phenylphenyl]benzonitrile is sourced from PubChem (CID 161466472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).