6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile

C31H19N3 — CID 134597730

IUPAC6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile
SMILESN#Cc1cccc2c1c1cc(-n3c4ccccc4c4ccccc43)ccc1n2-c1ccccc1
InChIInChI=1S/C31H19N3/c32-20-21-9-8-16-30-31(21)26-19-23(17-18-29(26)33(30)22-10-2-1-3-11-22)34-27-14-6-4-12-24(27)25-13-5-7-15-28(25)34/h1-19H
InChIKeyFBGRBOYTANGHAH-UHFFFAOYSA-N
MW433.51 g/mol
LogP7.75
Rot. Bonds2

About 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile

6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile (PubChem CID 134597730) has the molecular formula C31H19N3 and a molecular weight of 433.51 g/mol. Its IUPAC name is 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile.

Molecular Properties

Compound Name6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile
PubChem CID134597730
Molecular FormulaC31H19N3
Molecular Weight433.51 g/mol
Exact Mass433.16
IUPAC Name6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile
SMILESN#Cc1cccc2c1c1cc(-n3c4ccccc4c4ccccc43)ccc1n2-c1ccccc1
InChIInChI=1S/C31H19N3/c32-20-21-9-8-16-30-31(21)26-19-23(17-18-29(26)33(30)22-10-2-1-3-11-22)34-27-14-6-4-12-24(27)25-13-5-7-15-28(25)34/h1-19H
InChIKeyFBGRBOYTANGHAH-UHFFFAOYSA-N
XLogP7.75
TPSA33.65 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.51
LogP ≤ 57.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-carbazol-9-yl-9-[9-(3-triphenylsilylphenyl)carbazol-3-yl]carbazole-4-carbonitrile
CID 166588251
12-phenyl-5-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-8-carbonitrile
CID 134597839
5,12-diphenyl-2-(12-phenylindolo[3,2-c]carbazol-5-yl)indolo[3,2-c]carbazole-11-carbonitrile
CID 134598060
9-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-6-cyanophenyl]phenyl]carbazole-4-carbonitrile
CID 154958854
(5-cyano-9-phenylcarbazol-3-yl)boronic acid
CID 178064371
9-[4-[3-(3-carbazol-9-ylcarbazol-9-yl)-5-cyanophenyl]phenyl]carbazole-4-carbonitrile
CID 154958469
9-[2-[3-(3-carbazol-9-ylcarbazol-9-yl)-2-cyanophenyl]phenyl]carbazole-4-carbonitrile
CID 154958336
6-carbazol-9-yl-9-phenylcarbazole-3-carbonitrile
CID 134597724
3-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylcarbazole
CID 146337769
9-[2-[3-(4-carbazol-9-ylcarbazol-9-yl)phenyl]-3-cyanophenyl]carbazole-4-carbonitrile
CID 147595395
1-[(1Z)-buta-1,3-dienyl]-2-methyl-3-phenyl-10-(9-phenylcarbazol-3-yl)pyrrolo[3,2-a]carbazole-6-carbonitrile
CID 134604240
9-(6-cyanodibenzofuran-2-yl)carbazole-4-carbonitrile
CID 122501072

Frequently Asked Questions

What is the IUPAC name of 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile?
The IUPAC name of 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile (CID 134597730) is 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile.
What is the SMILES notation for 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile?
The canonical SMILES for 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile is N#Cc1cccc2c1c1cc(-n3c4ccccc4c4ccccc43)ccc1n2-c1ccccc1.
What is the InChIKey of 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile?
The InChIKey is FBGRBOYTANGHAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H19N3/c32-20-21-9-8-16-30-31(21)26-19-23(17-18-29(26)33(30)22-10-2-1-3-11-22)34-27-14-6-4-12-24(27)25-13-5-7-15-28(25)34/h1-19H.
What are the key properties of 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile?
6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile has a molecular weight of 433.51 g/mol, XLogP of 7.75, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-carbazol-9-yl-9-phenylcarbazole-4-carbonitrile is sourced from PubChem (CID 134597730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).