11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole

C51H33N3 — CID 155240185

IUPAC11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole
SMILESc1ccc(-c2cc(-c3ccc4c(-n5c6ccccc6c6cc7c(cc65)c5ccccc5n7-c5ccccc5)cccc4c3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C51H33N3/c1-4-15-34(16-5-1)45-30-38(31-46(52-45)35-17-6-2-7-18-35)36-27-28-40-37(29-36)19-14-26-47(40)54-49-25-13-11-23-42(49)44-32-50-43(33-51(44)54)41-22-10-12-24-48(41)53(50)39-20-8-3-9-21-39/h1-33H
InChIKeyMYJOYTAEEMSNFE-UHFFFAOYSA-N
MW687.85 g/mol
LogP13.43
Rot. Bonds5

About 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole

11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole (PubChem CID 155240185) has the molecular formula C51H33N3 and a molecular weight of 687.85 g/mol. Its IUPAC name is 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole.

Molecular Properties

Compound Name11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole
PubChem CID155240185
Molecular FormulaC51H33N3
Molecular Weight687.85 g/mol
Exact Mass687.27
IUPAC Name11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole
SMILESc1ccc(-c2cc(-c3ccc4c(-n5c6ccccc6c6cc7c(cc65)c5ccccc5n7-c5ccccc5)cccc4c3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C51H33N3/c1-4-15-34(16-5-1)45-30-38(31-46(52-45)35-17-6-2-7-18-35)36-27-28-40-37(29-36)19-14-26-47(40)54-49-25-13-11-23-42(49)44-32-50-43(33-51(44)54)41-22-10-12-24-48(41)53(50)39-20-8-3-9-21-39/h1-33H
InChIKeyMYJOYTAEEMSNFE-UHFFFAOYSA-N
XLogP13.43
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500687.85
LogP ≤ 513.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[6-(4,6-diphenylpyrimidin-2-yl)naphthalen-1-yl]-7-(3-phenylphenyl)indolo[2,3-b]carbazole
CID 156531320
3-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-2-yl]-9-phenylcarbazole;3-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 161437197
2-[9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 58511300
3-(2,6-diphenyl-4-pyridinyl)-9-phenylcarbazole
CID 70934573
2-[3-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-9-yl]phenyl]-9-phenylcarbazole
CID 118149380
7-phenyl-5-[6-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]indolo[2,3-b]carbazole
CID 149169033
2-(9-naphthalen-1-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 142356851
7-phenyl-5-[4-[4-phenyl-6-(4-phenylphenyl)-2-pyridinyl]phenyl]indolo[2,3-b]carbazole
CID 155240607
3-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 71286913
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(2,6-diphenyl-4-pyridinyl)carbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 167712900
11-[3,5-bis(4-phenylphenyl)phenyl]-5-phenylindolo[3,2-b]carbazole;5-(3,5-diphenylphenyl)-2,11-diphenylindolo[3,2-b]carbazole;11-(3,5-diphenylphenyl)-5-naphthalen-1-ylindolo[3,2-b]carbazole
CID 158931818
9-[4-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]phenyl]carbazole
CID 58943390

Frequently Asked Questions

What is the IUPAC name of 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole?
The IUPAC name of 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole (CID 155240185) is 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole.
What is the SMILES notation for 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole?
The canonical SMILES for 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole is c1ccc(-c2cc(-c3ccc4c(-n5c6ccccc6c6cc7c(cc65)c5ccccc5n7-c5ccccc5)cccc4c3)cc(-c3ccccc3)n2)cc1.
What is the InChIKey of 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole?
The InChIKey is MYJOYTAEEMSNFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H33N3/c1-4-15-34(16-5-1)45-30-38(31-46(52-45)35-17-6-2-7-18-35)36-27-28-40-37(29-36)19-14-26-47(40)54-49-25-13-11-23-42(49)44-32-50-43(33-51(44)54)41-22-10-12-24-48(41)53(50)39-20-8-3-9-21-39/h1-33H.
What are the key properties of 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole?
11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole has a molecular weight of 687.85 g/mol, XLogP of 13.43, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[6-(2,6-diphenyl-4-pyridinyl)naphthalen-1-yl]-5-phenylindolo[3,2-b]carbazole is sourced from PubChem (CID 155240185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).