1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole

C52H34N2 — CID 144508733

IUPAC1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole
SMILESc1ccc(-n2c(-c3ccc4ccccc4c3)cc3cc(-c4ccc5cc(-c6ccc7ccccc7c6)n(-c6ccc7ccccc7c6)c5c4)ccc32)cc1
InChIInChI=1S/C52H34N2/c1-2-16-47(17-3-1)53-49-27-25-41(30-46(49)34-52(53)44-22-19-36-11-5-8-14-39(36)29-44)42-20-23-45-33-51(43-21-18-35-10-4-7-13-38(35)28-43)54(50(45)32-42)48-26-24-37-12-6-9-15-40(37)31-48/h1-34H
InChIKeyXHLXYXHIEFMIOF-UHFFFAOYSA-N
MW686.86 g/mol
LogP14.03
Rot. Bonds5

About 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole

1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole (PubChem CID 144508733) has the molecular formula C52H34N2 and a molecular weight of 686.86 g/mol. Its IUPAC name is 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole.

Molecular Properties

Compound Name1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole
PubChem CID144508733
Molecular FormulaC52H34N2
Molecular Weight686.86 g/mol
Exact Mass686.27
IUPAC Name1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole
SMILESc1ccc(-n2c(-c3ccc4ccccc4c3)cc3cc(-c4ccc5cc(-c6ccc7ccccc7c6)n(-c6ccc7ccccc7c6)c5c4)ccc32)cc1
InChIInChI=1S/C52H34N2/c1-2-16-47(17-3-1)53-49-27-25-41(30-46(49)34-52(53)44-22-19-36-11-5-8-14-39(36)29-44)42-20-23-45-33-51(43-21-18-35-10-4-7-13-38(35)28-43)54(50(45)32-42)48-26-24-37-12-6-9-15-40(37)31-48/h1-34H
InChIKeyXHLXYXHIEFMIOF-UHFFFAOYSA-N
XLogP14.03
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500686.86
LogP ≤ 514.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole
CID 71230374
1-dibenzothiophen-2-yl-6-(1-naphthalen-2-yl-2-phenylindol-5-yl)-2-phenylindole
CID 144508678
2-[7-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenanthren-2-yl]-1-phenylindole
CID 144756297
3-[4-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]phenyl]-9-phenylcarbazole
CID 126764142
3,10,15-trinaphthalen-2-yl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene
CID 123252651
3-[4-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]-9-phenylcarbazole
CID 118919603
3-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 164948724
3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 118231204
1,2-bis(4-methylphenyl)indole
CID 151814608
3-[3-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole
CID 118919659
3-[3-[3-[3-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]phenyl]phenyl]-9-phenylcarbazole
CID 126764146
1-(9,9-dimethylfluoren-2-yl)-6-(1,2-diphenylindol-6-yl)-2-phenylindole
CID 71229871

Frequently Asked Questions

What is the IUPAC name of 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole?
The IUPAC name of 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole (CID 144508733) is 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole.
What is the SMILES notation for 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole?
The canonical SMILES for 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole is c1ccc(-n2c(-c3ccc4ccccc4c3)cc3cc(-c4ccc5cc(-c6ccc7ccccc7c6)n(-c6ccc7ccccc7c6)c5c4)ccc32)cc1.
What is the InChIKey of 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole?
The InChIKey is XHLXYXHIEFMIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H34N2/c1-2-16-47(17-3-1)53-49-27-25-41(30-46(49)34-52(53)44-22-19-36-11-5-8-14-39(36)29-44)42-20-23-45-33-51(43-21-18-35-10-4-7-13-38(35)28-43)54(50(45)32-42)48-26-24-37-12-6-9-15-40(37)31-48/h1-34H.
What are the key properties of 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole?
1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole has a molecular weight of 686.86 g/mol, XLogP of 14.03, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole is sourced from PubChem (CID 144508733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).