6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile

C37H20N2O2 — CID 153148571

IUPAC6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile
SMILESN#Cc1cc(-c2cccc3oc4ccccc4c23)cc2c1oc1c(-n3c4ccccc4c4ccccc43)cccc12
InChIInChI=1S/C37H20N2O2/c38-21-23-19-22(24-12-8-18-34-35(24)28-11-3-6-17-33(28)40-34)20-29-27-13-7-16-32(37(27)41-36(23)29)39-30-14-4-1-9-25(30)26-10-2-5-15-31(26)39/h1-20H
InChIKeyWAAHXGMNUWHAGX-UHFFFAOYSA-N
MW524.58 g/mol
LogP10.12
Rot. Bonds2

About 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile

6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile (PubChem CID 153148571) has the molecular formula C37H20N2O2 and a molecular weight of 524.58 g/mol. Its IUPAC name is 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile.

Molecular Properties

Compound Name6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile
PubChem CID153148571
Molecular FormulaC37H20N2O2
Molecular Weight524.58 g/mol
Exact Mass524.15
IUPAC Name6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile
SMILESN#Cc1cc(-c2cccc3oc4ccccc4c23)cc2c1oc1c(-n3c4ccccc4c4ccccc43)cccc12
InChIInChI=1S/C37H20N2O2/c38-21-23-19-22(24-12-8-18-34-35(24)28-11-3-6-17-33(28)40-34)20-29-27-13-7-16-32(37(27)41-36(23)29)39-30-14-4-1-9-25(30)26-10-2-5-15-31(26)39/h1-20H
InChIKeyWAAHXGMNUWHAGX-UHFFFAOYSA-N
XLogP10.12
TPSA55.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.58
LogP ≤ 510.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-carbazol-9-yl-2-dibenzofuran-4-yldibenzofuran-4-carbonitrile
CID 147298764
9-(6-cyano-8-dibenzofuran-4-yldibenzofuran-4-yl)carbazole-3-carbonitrile
CID 149026913
9-(8-dibenzofuran-1-yl-6-phenyldibenzofuran-4-yl)carbazole-2-carbonitrile
CID 147134992
2-dibenzofuran-4-yl-6-(3,6-diphenylcarbazol-9-yl)dibenzofuran-4-carbonitrile
CID 147295774
9-(6-cyano-8-dibenzofuran-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile
CID 149228973
9-(9-dibenzofuran-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile
CID 149138143
6-carbazol-9-yl-2-dibenzothiophen-3-yldibenzofuran-4-carbonitrile
CID 149287115
9-(9-dibenzofuran-1-yl-6-phenyldibenzofuran-4-yl)carbazole-3-carbonitrile
CID 147906665
9-(9-dibenzofuran-1-yl-6-phenyldibenzofuran-4-yl)-2-phenylcarbazole
CID 148764046
9-(9-dibenzofuran-2-yldibenzofuran-4-yl)-3-phenylcarbazole
CID 153223652
9-(6-cyano-8-dibenzothiophen-2-yldibenzofuran-4-yl)carbazole-2-carbonitrile
CID 146810331
2-[9-[4-dibenzofuran-1-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]benzonitrile
CID 155232743

Frequently Asked Questions

What is the IUPAC name of 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile?
The IUPAC name of 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile (CID 153148571) is 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile.
What is the SMILES notation for 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile?
The canonical SMILES for 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile is N#Cc1cc(-c2cccc3oc4ccccc4c23)cc2c1oc1c(-n3c4ccccc4c4ccccc43)cccc12.
What is the InChIKey of 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile?
The InChIKey is WAAHXGMNUWHAGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H20N2O2/c38-21-23-19-22(24-12-8-18-34-35(24)28-11-3-6-17-33(28)40-34)20-29-27-13-7-16-32(37(27)41-36(23)29)39-30-14-4-1-9-25(30)26-10-2-5-15-31(26)39/h1-20H.
What are the key properties of 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile?
6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile has a molecular weight of 524.58 g/mol, XLogP of 10.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-carbazol-9-yl-2-dibenzofuran-1-yldibenzofuran-4-carbonitrile is sourced from PubChem (CID 153148571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).