9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile

C39H19N7 — CID 155179704

IUPAC9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile
SMILESN#Cc1ccc(-c2cc(-n3c4ccccc4c4ccccc43)nc(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)c2)c(C#N)c1
InChIInChI=1S/C39H19N7/c40-20-24-9-12-29(28(15-24)23-43)27-18-38(45-34-7-3-1-5-30(34)31-6-2-4-8-35(31)45)44-39(19-27)46-36-13-10-25(21-41)16-32(36)33-17-26(22-42)11-14-37(33)46/h1-19H
InChIKeyIOYGSZHDPFZOLE-UHFFFAOYSA-N
MW585.63 g/mol
LogP8.43
Rot. Bonds3

About 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile

9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile (PubChem CID 155179704) has the molecular formula C39H19N7 and a molecular weight of 585.63 g/mol. Its IUPAC name is 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile.

Molecular Properties

Compound Name9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile
PubChem CID155179704
Molecular FormulaC39H19N7
Molecular Weight585.63 g/mol
Exact Mass585.17
IUPAC Name9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile
SMILESN#Cc1ccc(-c2cc(-n3c4ccccc4c4ccccc43)nc(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)c2)c(C#N)c1
InChIInChI=1S/C39H19N7/c40-20-24-9-12-29(28(15-24)23-43)27-18-38(45-34-7-3-1-5-30(34)31-6-2-4-8-35(31)45)44-39(19-27)46-36-13-10-25(21-41)16-32(36)33-17-26(22-42)11-14-37(33)46/h1-19H
InChIKeyIOYGSZHDPFZOLE-UHFFFAOYSA-N
XLogP8.43
TPSA117.91 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500585.63
LogP ≤ 58.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

9-[6-carbazol-9-yl-4-(2-cyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312383
9-[6-carbazol-9-yl-4-[2-(4-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312324
9-[3-carbazol-9-yl-5-(2,4-dicyanophenyl)phenyl]carbazole-3,6-dicarbonitrile
CID 121312407
9-[6-carbazol-9-yl-4-(4-cyanophenyl)-2-pyridinyl]carbazole-3-carbonitrile;9-[6-carbazol-9-yl-4-(2-cyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile;9-[6-carbazol-9-yl-4-(3-cyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile;9-[6-carbazol-9-yl-4-(4-cyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 165039885
9-(6-carbazol-9-yl-2-pyridinyl)carbazole-3,6-dicarbonitrile
CID 118650226
9-[6-carbazol-9-yl-4-[3-(3-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312485
9-[6-carbazol-9-yl-4-[2-(2-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3-carbonitrile;9-[6-carbazol-9-yl-4-[2-(3-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3-carbonitrile;9-[6-carbazol-9-yl-4-[2-(4-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3-carbonitrile;9-[6-carbazol-9-yl-4-[2-(2-cyanophenyl)phenyl]-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 158469733
9-[4-[2-(2-cyanophenyl)phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312480
9-[4-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-3-cyanophenyl]carbazole-3-carbonitrile
CID 154958191
9-[4-[2-[2-(4-cyanophenyl)phenyl]phenyl]-6-pyrido[2,3-b]indol-9-yl-2-pyridinyl]carbazole-3,6-dicarbonitrile
CID 121312507
9-[3-carbazol-9-yl-5-[2-[2-[2-(4-cyanophenyl)phenyl]phenyl]phenyl]phenyl]carbazole-3,6-dicarbonitrile;2-[2-[2-[2,6-di(carbazol-9-yl)-4-pyridinyl]phenyl]phenyl]benzonitrile;3-[2-[2-[2,6-di(carbazol-9-yl)-4-pyridinyl]phenyl]phenyl]benzonitrile
CID 164964760
9-[3-cyano-4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole-3-carbonitrile
CID 134508127

Frequently Asked Questions

What is the IUPAC name of 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile?
The IUPAC name of 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile (CID 155179704) is 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile.
What is the SMILES notation for 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile?
The canonical SMILES for 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile is N#Cc1ccc(-c2cc(-n3c4ccccc4c4ccccc43)nc(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)c2)c(C#N)c1.
What is the InChIKey of 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile?
The InChIKey is IOYGSZHDPFZOLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H19N7/c40-20-24-9-12-29(28(15-24)23-43)27-18-38(45-34-7-3-1-5-30(34)31-6-2-4-8-35(31)45)44-39(19-27)46-36-13-10-25(21-41)16-32(36)33-17-26(22-42)11-14-37(33)46/h1-19H.
What are the key properties of 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile?
9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile has a molecular weight of 585.63 g/mol, XLogP of 8.43, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-carbazol-9-yl-4-(2,4-dicyanophenyl)-2-pyridinyl]carbazole-3,6-dicarbonitrile is sourced from PubChem (CID 155179704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).