6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile

C191H99N11O10 — CID 161279890

IUPAC6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile
SMILESN#Cc1cc(-c2cccc3c2oc2ccccc23)cc(-c2ccccc2)c1-c1cccc2c1oc1ccccc12.N#Cc1ccc(-c2cc(-c3cccc4c3oc3ccccc34)c(C#N)cc2-c2cccc3c2oc2ccccc23)c(C#N)c1.N#Cc1ccc2oc3c(-c4ccc(-c5cccc6c5oc5ccc(C#N)cc56)c(-c5ccccc5C#N)c4)cccc3c2c1.N#Cc1ccc2oc3c(-c4ccc(-c5cccc6c5oc5ccccc56)c(-c5ccccc5C#N)c4)cccc3c2c1.N#Cc1ccccc1-c1c(-c2cccc3c2oc2ccccc23)ccc(-c2cccc3c2oc2ccccc23)c1C#N
InChIInChI=1S/2C39H19N3O2.2C38H20N2O2.C37H21NO2/c40-20-23-15-16-26(24(17-23)21-41)35-19-33(31-11-5-9-29-27-7-1-3-13-36(27)43-38(29)31)25(22-42)18-34(35)32-12-6-10-30-28-8-2-4-14-37(28)44-39(30)32;40-20-23-11-15-36-34(17-23)31-9-3-7-28(38(31)43-36)25-13-14-29(33(19-25)27-6-2-1-5-26(27)22-42)30-8-4-10-32-35-18-24(21-41)12-16-37(35)44-39(30)32;39-21-23-9-1-2-10-24(23)36-28(32-16-8-15-31-27-12-4-6-18-35(27)42-38(31)32)20-19-25(33(36)22-40)29-13-7-14-30-26-11-3-5-17-34(26)41-37(29)30;39-21-23-15-18-36-34(19-23)32-13-5-10-27(37(32)42-36)24-16-17-28(33(20-24)26-8-2-1-7-25(26)22-40)30-11-6-12-31-29-9-3-4-14-35(29)41-38(30)31;38-22-25-20-24(26-14-8-15-29-27-12-4-6-18-33(27)39-36(26)29)21-32(23-10-2-1-3-11-23)35(25)31-17-9-16-30-28-13-5-7-19-34(28)40-37(30)31/h2*1-19H;2*1-20H;1-21H
InChIKeyVEYCACHZZGGUKN-UHFFFAOYSA-N
MW2707.96 g/mol
LogP51.02
Rot. Bonds15

About 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile

6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile (PubChem CID 161279890) has the molecular formula C191H99N11O10 and a molecular weight of 2707.96 g/mol. Its IUPAC name is 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile.

Molecular Properties

Compound Name6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile
PubChem CID161279890
Molecular FormulaC191H99N11O10
Molecular Weight2707.96 g/mol
Exact Mass2705.76
IUPAC Name6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile
SMILESN#Cc1cc(-c2cccc3c2oc2ccccc23)cc(-c2ccccc2)c1-c1cccc2c1oc1ccccc12.N#Cc1ccc(-c2cc(-c3cccc4c3oc3ccccc34)c(C#N)cc2-c2cccc3c2oc2ccccc23)c(C#N)c1.N#Cc1ccc2oc3c(-c4ccc(-c5cccc6c5oc5ccc(C#N)cc56)c(-c5ccccc5C#N)c4)cccc3c2c1.N#Cc1ccc2oc3c(-c4ccc(-c5cccc6c5oc5ccccc56)c(-c5ccccc5C#N)c4)cccc3c2c1.N#Cc1ccccc1-c1c(-c2cccc3c2oc2ccccc23)ccc(-c2cccc3c2oc2ccccc23)c1C#N
InChIInChI=1S/2C39H19N3O2.2C38H20N2O2.C37H21NO2/c40-20-23-15-16-26(24(17-23)21-41)35-19-33(31-11-5-9-29-27-7-1-3-13-36(27)43-38(29)31)25(22-42)18-34(35)32-12-6-10-30-28-8-2-4-14-37(28)44-39(30)32;40-20-23-11-15-36-34(17-23)31-9-3-7-28(38(31)43-36)25-13-14-29(33(19-25)27-6-2-1-5-26(27)22-42)30-8-4-10-32-35-18-24(21-41)12-16-37(35)44-39(30)32;39-21-23-9-1-2-10-24(23)36-28(32-16-8-15-31-27-12-4-6-18-35(27)42-38(31)32)20-19-25(33(36)22-40)29-13-7-14-30-26-11-3-5-17-34(26)41-37(29)30;39-21-23-15-18-36-34(19-23)32-13-5-10-27(37(32)42-36)24-16-17-28(33(20-24)26-8-2-1-7-25(26)22-40)30-11-6-12-31-29-9-3-4-14-35(29)41-38(30)31;38-22-25-20-24(26-14-8-15-29-27-12-4-6-18-33(27)39-36(26)29)21-32(23-10-2-1-3-11-23)35(25)31-17-9-16-30-28-13-5-7-19-34(28)40-37(30)31/h2*1-19H;2*1-20H;1-21H
InChIKeyVEYCACHZZGGUKN-UHFFFAOYSA-N
XLogP51.02
TPSA393.09 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds15
Heavy Atoms212
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002707.96
LogP ≤ 551.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile with MolForge

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Related Compounds

8-[3-(8-cyanodibenzofuran-2-yl)-5-[2-(2-cyanophenyl)phenyl]phenyl]dibenzofuran-2-carbonitrile;4-[3-(7-cyanodibenzofuran-2-yl)-5-dibenzofuran-2-ylphenyl]-5-phenylbenzene-1,3-dicarbonitrile;8-[3-[2-(2-cyanophenyl)phenyl]-5-dibenzofuran-2-ylphenyl]dibenzofuran-2-carbonitrile;2-[3-dibenzofuran-2-yl-5-(8-phenyldibenzofuran-2-yl)phenyl]-3-phenylbenzonitrile;4-dibenzofuran-2-yl-2-(6-phenyldibenzofuran-2-yl)-6-(2-phenylphenyl)benzonitrile
CID 157052596
3-[4-(3-cyano-5-dibenzofuran-4-ylphenyl)phenyl]-5-dibenzofuran-4-ylbenzonitrile;5-[3-(3-cyano-4-dibenzofuran-4-ylphenyl)phenyl]-2-dibenzofuran-4-ylbenzonitrile;3-[3-(3-cyano-5-dibenzofuran-4-ylphenyl)-5-phenylphenyl]-5-dibenzofuran-4-ylbenzonitrile;3-[3-(3-cyano-5-dibenzofuran-4-ylphenyl)-5-(3-phenylphenyl)phenyl]-5-dibenzofuran-4-ylbenzonitrile;3-[3-(3-cyano-5-dibenzofuran-4-ylphenyl)-5-(4-phenylphenyl)phenyl]-5-dibenzofuran-4-ylbenzonitrile;3-dibenzofuran-4-yl-5-[4-(3-dibenzofuran-4-ylphenyl)phenyl]benzonitrile;3-dibenzofuran-4-yl-5-[4-(4-dibenzofuran-4-ylphenyl)phenyl]benzonitrile;3-dibenzofuran-4-yl-5-[3-(3-dibenzofuran-4-ylphenyl)-5-phenylphenyl]benzonitrile
CID 159814900
2-(5-dibenzofuran-2-yl-2-dibenzofuran-4-ylphenyl)benzonitrile
CID 146354764
2-(2-cyanophenyl)-6-dibenzofuran-2-yl-4-dibenzofuran-4-ylbenzonitrile
CID 146353825
6-(3-dibenzofuran-4-ylphenyl)dibenzofuran-2-carbonitrile
CID 121298243
6-[3-(2-cyanophenyl)-5-dibenzofuran-3-ylphenyl]dibenzofuran-2-carbonitrile
CID 146354689
2-(3-cyanophenyl)-4-dibenzofuran-2-yl-6-dibenzofuran-4-ylbenzene-1,3-dicarbonitrile
CID 146355240
4-dibenzofuran-3-yl-5-dibenzofuran-4-yl-2-phenylbenzonitrile
CID 146354609
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
4-[4-cyano-3,5-di(dibenzofuran-2-yl)phenyl]benzene-1,3-dicarbonitrile
CID 146354530
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-(2-cyanophenyl)-3,6-di(dibenzofuran-2-yl)benzonitrile
CID 146354517

Frequently Asked Questions

What is the IUPAC name of 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile?
The IUPAC name of 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile (CID 161279890) is 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile.
What is the SMILES notation for 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile?
The canonical SMILES for 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile is N#Cc1cc(-c2cccc3c2oc2ccccc23)cc(-c2ccccc2)c1-c1cccc2c1oc1ccccc12.N#Cc1ccc(-c2cc(-c3cccc4c3oc3ccccc34)c(C#N)cc2-c2cccc3c2oc2ccccc23)c(C#N)c1.N#Cc1ccc2oc3c(-c4ccc(-c5cccc6c5oc5ccc(C#N)cc56)c(-c5ccccc5C#N)c4)cccc3c2c1.N#Cc1ccc2oc3c(-c4ccc(-c5cccc6c5oc5ccccc56)c(-c5ccccc5C#N)c4)cccc3c2c1.N#Cc1ccccc1-c1c(-c2cccc3c2oc2ccccc23)ccc(-c2cccc3c2oc2ccccc23)c1C#N.
What is the InChIKey of 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile?
The InChIKey is VEYCACHZZGGUKN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C39H19N3O2.2C38H20N2O2.C37H21NO2/c40-20-23-15-16-26(24(17-23)21-41)35-19-33(31-11-5-9-29-27-7-1-3-13-36(27)43-38(29)31)25(22-42)18-34(35)32-12-6-10-30-28-8-2-4-14-37(28)44-39(30)32;40-20-23-11-15-36-34(17-23)31-9-3-7-28(38(31)43-36)25-13-14-29(33(19-25)27-6-2-1-5-26(27)22-42)30-8-4-10-32-35-18-24(21-41)12-16-37(35)44-39(30)32;39-21-23-9-1-2-10-24(23)36-28(32-16-8-15-31-27-12-4-6-18-35(27)42-38(31)32)20-19-25(33(36)22-40)29-13-7-14-30-26-11-3-5-17-34(26)41-37(29)30;39-21-23-15-18-36-34(19-23)32-13-5-10-27(37(32)42-36)24-16-17-28(33(20-24)26-8-2-1-7-25(26)22-40)30-11-6-12-31-29-9-3-4-14-35(29)41-38(30)31;38-22-25-20-24(26-14-8-15-29-27-12-4-6-18-33(27)39-36(26)29)21-32(23-10-2-1-3-11-23)35(25)31-17-9-16-30-28-13-5-7-19-34(28)40-37(30)31/h2*1-19H;2*1-20H;1-21H.
What are the key properties of 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile?
6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile has a molecular weight of 2707.96 g/mol, XLogP of 51.02, 15 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(8-cyanodibenzofuran-4-yl)-3-(2-cyanophenyl)phenyl]dibenzofuran-2-carbonitrile;4-[4-cyano-2,5-di(dibenzofuran-4-yl)phenyl]benzene-1,3-dicarbonitrile;6-[3-(2-cyanophenyl)-4-dibenzofuran-4-ylphenyl]dibenzofuran-2-carbonitrile;2-(2-cyanophenyl)-3,6-di(dibenzofuran-4-yl)benzonitrile;2,5-di(dibenzofuran-4-yl)-3-phenylbenzonitrile is sourced from PubChem (CID 161279890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).