2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile

C37H22N2O — CID 148667920

IUPAC2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile
SMILESN#Cc1ccccc1-c1cccc2c1c1cc(-c3ccc4oc5ccccc5c4c3)ccc1n2-c1ccccc1
InChIInChI=1S/C37H22N2O/c38-23-26-9-4-5-12-28(26)30-14-8-15-34-37(30)32-22-24(17-19-33(32)39(34)27-10-2-1-3-11-27)25-18-20-36-31(21-25)29-13-6-7-16-35(29)40-36/h1-22H
InChIKeyNPCQJZMKMNNRSM-UHFFFAOYSA-N
MW510.60 g/mol
LogP9.89
Rot. Bonds3

About 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile

2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile (PubChem CID 148667920) has the molecular formula C37H22N2O and a molecular weight of 510.60 g/mol. Its IUPAC name is 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile.

Molecular Properties

Compound Name2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile
PubChem CID148667920
Molecular FormulaC37H22N2O
Molecular Weight510.60 g/mol
Exact Mass510.17
IUPAC Name2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile
SMILESN#Cc1ccccc1-c1cccc2c1c1cc(-c3ccc4oc5ccccc5c4c3)ccc1n2-c1ccccc1
InChIInChI=1S/C37H22N2O/c38-23-26-9-4-5-12-28(26)30-14-8-15-34-37(30)32-22-24(17-19-33(32)39(34)27-10-2-1-3-11-27)25-18-20-36-31(21-25)29-13-6-7-16-35(29)40-36/h1-22H
InChIKeyNPCQJZMKMNNRSM-UHFFFAOYSA-N
XLogP9.89
TPSA41.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.60
LogP ≤ 59.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile 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

2-[3-([1]benzofuro[3,2-b]carbazol-11-yl)-5-(9-phenylcarbazol-3-yl)phenyl]benzonitrile
CID 139339701
5-(4,6-diphenylpyrimidin-2-yl)-3-[8-[5-(4,6-diphenylpyrimidin-2-yl)-9-phenylcarbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 129292169
3,6-di(dibenzofuran-2-yl)-9-[2-[4-(9-phenylcarbazol-4-yl)phenyl]phenyl]carbazole
CID 166037350
9-dibenzofuran-2-yl-5-phenyl-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 170072865
3-dibenzofuran-2-yl-6-fluoranthen-3-yl-9-phenylcarbazole
CID 122434706
2-[8-(3-carbazol-9-ylcarbazol-9-yl)dibenzofuran-2-yl]benzonitrile
CID 122552677
3-(2-dibenzofuran-2-ylphenyl)-9-phenylcarbazole
CID 139423478
3-(8,15-dioxatetracyclo[14.4.0.02,7.09,14]icosa-1(20),2(7),3,5,9,11,13,16,18-nonaen-4-yl)-9-phenylcarbazole
CID 145223329
3-(3-carbazol-9-ylphenyl)-9-phenylcarbazole;9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 158532240
14-phenyl-18-(9-phenylcarbazol-3-yl)-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene
CID 118298646
N-dibenzofuran-2-yl-9-phenyl-N,5-bis(4-phenylphenyl)carbazol-3-amine
CID 169010452
3-(8-dibenzofuran-2-yldibenzofuran-2-yl)-6,9-diphenylcarbazole
CID 71278016

Frequently Asked Questions

What is the IUPAC name of 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile?
The IUPAC name of 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile (CID 148667920) is 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile.
What is the SMILES notation for 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile?
The canonical SMILES for 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile is N#Cc1ccccc1-c1cccc2c1c1cc(-c3ccc4oc5ccccc5c4c3)ccc1n2-c1ccccc1.
What is the InChIKey of 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile?
The InChIKey is NPCQJZMKMNNRSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H22N2O/c38-23-26-9-4-5-12-28(26)30-14-8-15-34-37(30)32-22-24(17-19-33(32)39(34)27-10-2-1-3-11-27)25-18-20-36-31(21-25)29-13-6-7-16-35(29)40-36/h1-22H.
What are the key properties of 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile?
2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile has a molecular weight of 510.60 g/mol, XLogP of 9.89, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-dibenzofuran-2-yl-9-phenylcarbazol-4-yl)benzonitrile is sourced from PubChem (CID 148667920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).