4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile

C150H99N9O — CID 159906958

IUPAC4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cc(-c5ccc(C#N)cc5)cc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3cc21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4cc(-c5ccc(C#N)cc5)cc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3c21.N#Cc1ccc(-c2cc(-c3cccc(-c4ccccc4)n3)cc(-n3c4ccccc4c4ccc(-c5cccc6c5oc5ccccc56)cc43)c2)cc1
InChIInChI=1S/2C51H35N3.C48H29N3O/c1-51(2)45-19-11-9-17-41(45)43-30-44-42-18-10-12-20-49(42)54(50(44)31-46(43)51)40-26-37(35-23-21-33(32-52)22-24-35)25-39(27-40)48-29-38(34-13-5-3-6-14-34)28-47(53-48)36-15-7-4-8-16-36;1-51(2)45-19-11-9-17-41(45)43-25-26-44-42-18-10-12-20-48(42)54(50(44)49(43)51)40-28-37(35-23-21-33(32-52)22-24-35)27-39(29-40)47-31-38(34-13-5-3-6-14-34)30-46(53-47)36-15-7-4-8-16-36;49-30-31-20-22-32(23-21-31)35-26-36(44-17-9-16-43(50-44)33-10-2-1-3-11-33)28-37(27-35)51-45-18-6-4-12-39(45)40-25-24-34(29-46(40)51)38-14-8-15-42-41-13-5-7-19-47(41)52-48(38)42/h2*3-31H,1-2H3;1-29H
InChIKeyNWRUWQFWDVDENH-UHFFFAOYSA-N
MW2043.50 g/mol
LogP38.67
Rot. Bonds15

About 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile

4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile (PubChem CID 159906958) has the molecular formula C150H99N9O and a molecular weight of 2043.50 g/mol. Its IUPAC name is 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile.

Molecular Properties

Compound Name4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile
PubChem CID159906958
Molecular FormulaC150H99N9O
Molecular Weight2043.50 g/mol
Exact Mass2041.80
IUPAC Name4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile
SMILESCC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cc(-c5ccc(C#N)cc5)cc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3cc21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4cc(-c5ccc(C#N)cc5)cc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3c21.N#Cc1ccc(-c2cc(-c3cccc(-c4ccccc4)n3)cc(-n3c4ccccc4c4ccc(-c5cccc6c5oc5ccccc56)cc43)c2)cc1
InChIInChI=1S/2C51H35N3.C48H29N3O/c1-51(2)45-19-11-9-17-41(45)43-30-44-42-18-10-12-20-49(42)54(50(44)31-46(43)51)40-26-37(35-23-21-33(32-52)22-24-35)25-39(27-40)48-29-38(34-13-5-3-6-14-34)28-47(53-48)36-15-7-4-8-16-36;1-51(2)45-19-11-9-17-41(45)43-25-26-44-42-18-10-12-20-48(42)54(50(44)49(43)51)40-28-37(35-23-21-33(32-52)22-24-35)27-39(29-40)47-31-38(34-13-5-3-6-14-34)30-46(53-47)36-15-7-4-8-16-36;49-30-31-20-22-32(23-21-31)35-26-36(44-17-9-16-43(50-44)33-10-2-1-3-11-33)28-37(27-35)51-45-18-6-4-12-39(45)40-25-24-34(29-46(40)51)38-14-8-15-42-41-13-5-7-19-47(41)52-48(38)42/h2*3-31H,1-2H3;1-29H
InChIKeyNWRUWQFWDVDENH-UHFFFAOYSA-N
XLogP38.67
TPSA137.97 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds15
Heavy Atoms160
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002043.50
LogP ≤ 538.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile with MolForge

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Related Compounds

4-[3-(3-carbazol-9-ylcarbazol-9-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzonitrile
CID 161328818
4-[3-(11,11-dimethylindeno[1,2-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile
CID 140922408
4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(2,6-diphenylpyrimidin-4-yl)phenyl]benzonitrile
CID 140922153
4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(2-phenylquinolin-4-yl)phenyl]benzonitrile;4-[3-(11,11-dimethylindeno[1,2-b]carbazol-5-yl)-5-(4-phenylquinolin-2-yl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)-5-(4-phenylquinolin-2-yl)phenyl]benzonitrile
CID 157394958
12-[3-[3-[5-(3-dibenzofuran-4-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]phenyl]-11-(3-phenylphenyl)indolo[2,3-a]carbazole
CID 123161041
4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(2-phenylquinolin-4-yl)phenyl]benzonitrile
CID 140922496
3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(2,6-diphenyl-4-pyridinyl)phenyl]-5-naphthalen-1-ylbenzonitrile
CID 140922135
3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]benzonitrile
CID 129225677
5-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(2,6-diphenyl-4-pyridinyl)phenyl]-2-(4-phenylphenyl)benzonitrile
CID 140922574
11-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-12,12-dimethylindeno[2,1-a]carbazole
CID 90225215
3-[3-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]-5-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]benzonitrile
CID 140922348
5-(3,5-diphenylphenyl)-[1]benzofuro[3,2-c]carbazole;5-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-11,11-dimethylindeno[1,2-b]carbazole
CID 159969204

Frequently Asked Questions

What is the IUPAC name of 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile?
The IUPAC name of 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile (CID 159906958) is 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile.
What is the SMILES notation for 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile?
The canonical SMILES for 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile is CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4cc(-c5ccc(C#N)cc5)cc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3cc21.CC1(C)c2ccccc2-c2ccc3c4ccccc4n(-c4cc(-c5ccc(C#N)cc5)cc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3c21.N#Cc1ccc(-c2cc(-c3cccc(-c4ccccc4)n3)cc(-n3c4ccccc4c4ccc(-c5cccc6c5oc5ccccc56)cc43)c2)cc1.
What is the InChIKey of 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile?
The InChIKey is NWRUWQFWDVDENH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C51H35N3.C48H29N3O/c1-51(2)45-19-11-9-17-41(45)43-30-44-42-18-10-12-20-49(42)54(50(44)31-46(43)51)40-26-37(35-23-21-33(32-52)22-24-35)25-39(27-40)48-29-38(34-13-5-3-6-14-34)28-47(53-48)36-15-7-4-8-16-36;1-51(2)45-19-11-9-17-41(45)43-25-26-44-42-18-10-12-20-48(42)54(50(44)49(43)51)40-28-37(35-23-21-33(32-52)22-24-35)27-39(29-40)47-31-38(34-13-5-3-6-14-34)30-46(53-47)36-15-7-4-8-16-36;49-30-31-20-22-32(23-21-31)35-26-36(44-17-9-16-43(50-44)33-10-2-1-3-11-33)28-37(27-35)51-45-18-6-4-12-39(45)40-25-24-34(29-46(40)51)38-14-8-15-42-41-13-5-7-19-47(41)52-48(38)42/h2*3-31H,1-2H3;1-29H.
What are the key properties of 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile?
4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile has a molecular weight of 2043.50 g/mol, XLogP of 38.67, 15 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2-dibenzofuran-4-ylcarbazol-9-yl)-5-(6-phenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile;4-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)-5-(4,6-diphenyl-2-pyridinyl)phenyl]benzonitrile is sourced from PubChem (CID 159906958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).