9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile

C26H13N3O — CID 122501059

IUPAC9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile
SMILESN#Cc1ccc2c(c1)c1ccccc1n2-c1ccc2oc3c(C#N)cccc3c2c1
InChIInChI=1S/C26H13N3O/c27-14-16-8-10-24-21(12-16)19-5-1-2-7-23(19)29(24)18-9-11-25-22(13-18)20-6-3-4-17(15-28)26(20)30-25/h1-13H
InChIKeyQKOAAROTONKSRY-UHFFFAOYSA-N
MW383.41 g/mol
LogP6.43
Rot. Bonds1

About 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile

9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile (PubChem CID 122501059) has the molecular formula C26H13N3O and a molecular weight of 383.41 g/mol. Its IUPAC name is 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile.

Molecular Properties

Compound Name9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile
PubChem CID122501059
Molecular FormulaC26H13N3O
Molecular Weight383.41 g/mol
Exact Mass383.11
IUPAC Name9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile
SMILESN#Cc1ccc2c(c1)c1ccccc1n2-c1ccc2oc3c(C#N)cccc3c2c1
InChIInChI=1S/C26H13N3O/c27-14-16-8-10-24-21(12-16)19-5-1-2-7-23(19)29(24)18-9-11-25-22(13-18)20-6-3-4-17(15-28)26(20)30-25/h1-13H
InChIKeyQKOAAROTONKSRY-UHFFFAOYSA-N
XLogP6.43
TPSA65.65 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.41
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-[9-(6-cyanodibenzofuran-2-yl)carbazol-3-yl]carbazole-3,6-dicarbonitrile
CID 122501116
9-[8-(3-cyanocarbazol-9-yl)dibenzofuran-2-yl]carbazole-3-carbonitrile
CID 118386470
9-(8-carbazol-9-yldibenzofuran-2-yl)carbazole-3,6-dicarbonitrile
CID 118396755
9-(6-carbazol-9-yldibenzofuran-2-yl)carbazole-3-carbonitrile;ethane;propane
CID 145345110
9-(6-cyanodibenzofuran-2-yl)carbazole-4-carbonitrile
CID 122501072
9-(6-cyanodibenzofuran-2-yl)carbazole-1-carbonitrile
CID 122498876
9-[9-(2-cyanodibenzofuran-4-yl)carbazol-3-yl]carbazole-3,6-dicarbonitrile
CID 122501143
9-[8-(2-methylcarbazol-9-yl)dibenzofuran-4-yl]carbazole-2-carbonitrile
CID 126754672
6-(benzimidazol-1-yl)-9-(6-carbazol-9-yldibenzofuran-2-yl)carbazole-3-carbonitrile
CID 134343651
9-[6,8-di(carbazol-9-yl)dibenzofuran-2-yl]-6-phenylcarbazole-3-carbonitrile
CID 134343534
6-carbazol-9-yl-9-phenylcarbazole-3-carbonitrile
CID 134597724
9-[6,8-di(carbazol-9-yl)dibenzofuran-2-yl]-6-isocyanocarbazole-3-carbonitrile
CID 140850520

Frequently Asked Questions

What is the IUPAC name of 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile?
The IUPAC name of 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile (CID 122501059) is 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile.
What is the SMILES notation for 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile?
The canonical SMILES for 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile is N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc2oc3c(C#N)cccc3c2c1.
What is the InChIKey of 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile?
The InChIKey is QKOAAROTONKSRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H13N3O/c27-14-16-8-10-24-21(12-16)19-5-1-2-7-23(19)29(24)18-9-11-25-22(13-18)20-6-3-4-17(15-28)26(20)30-25/h1-13H.
What are the key properties of 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile?
9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile has a molecular weight of 383.41 g/mol, XLogP of 6.43, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(6-cyanodibenzofuran-2-yl)carbazole-3-carbonitrile is sourced from PubChem (CID 122501059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).