N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline

C136H95N9 — CID 158842849

IUPACN,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-n4c5ccccc5c5c6ccccc6n(-c6ccccc6)c54)cc3)cc2)cc1.c1ccc(-c2ccccc2N(c2ccc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc2)cc1
InChIInChI=1S/C50H35N3.C48H33N3.C38H27N3/c1-4-14-36(15-5-1)38-24-28-41(29-25-38)51(42-30-26-39(27-31-42)37-16-6-2-7-17-37)43-32-34-44(35-33-43)53-48-23-13-11-21-46(48)49-45-20-10-12-22-47(45)52(50(49)53)40-18-8-3-9-19-40;1-3-16-34(17-4-1)39-23-9-12-26-43(39)49(44-29-15-19-35-18-7-8-22-40(35)44)37-30-32-38(33-31-37)51-46-28-14-11-25-42(46)47-41-24-10-13-27-45(41)50(48(47)51)36-20-5-2-6-21-36;1-4-14-28(15-5-1)39(29-16-6-2-7-17-29)31-24-26-32(27-25-31)41-36-23-13-11-21-34(36)37-33-20-10-12-22-35(33)40(38(37)41)30-18-8-3-9-19-30/h1-35H;1-33H;1-27H
InChIKeyIYLQFHBSZWPAOP-UHFFFAOYSA-N
MW1855.32 g/mol
LogP36.75
Rot. Bonds18

About N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline

N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline (PubChem CID 158842849) has the molecular formula C136H95N9 and a molecular weight of 1855.32 g/mol. Its IUPAC name is N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline
PubChem CID158842849
Molecular FormulaC136H95N9
Molecular Weight1855.32 g/mol
Exact Mass1853.77
IUPAC NameN,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-n4c5ccccc5c5c6ccccc6n(-c6ccccc6)c54)cc3)cc2)cc1.c1ccc(-c2ccccc2N(c2ccc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc2)cc1
InChIInChI=1S/C50H35N3.C48H33N3.C38H27N3/c1-4-14-36(15-5-1)38-24-28-41(29-25-38)51(42-30-26-39(27-31-42)37-16-6-2-7-17-37)43-32-34-44(35-33-43)53-48-23-13-11-21-46(48)49-45-20-10-12-22-47(45)52(50(49)53)40-18-8-3-9-19-40;1-3-16-34(17-4-1)39-23-9-12-26-43(39)49(44-29-15-19-35-18-7-8-22-40(35)44)37-30-32-38(33-31-37)51-46-28-14-11-25-42(46)47-41-24-10-13-27-45(41)50(48(47)51)36-20-5-2-6-21-36;1-4-14-28(15-5-1)39(29-16-6-2-7-17-29)31-24-26-32(27-25-31)41-36-23-13-11-21-34(36)37-33-20-10-12-22-35(33)40(38(37)41)30-18-8-3-9-19-30/h1-35H;1-33H;1-27H
InChIKeyIYLQFHBSZWPAOP-UHFFFAOYSA-N
XLogP36.75
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms145
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001855.32
LogP ≤ 536.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline with MolForge

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Related Compounds

5,6-diphenyl-N,N-bis(4-phenylphenyl)indolo[2,3-b]indol-2-amine;N-[4-(5,6-diphenylindolo[2,3-b]indol-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N,5,6-triphenyl-N-(2-phenylphenyl)indolo[2,3-b]indol-3-amine
CID 158019802
N-(4-benzo[c]carbazol-7-ylphenyl)-N,2-bis(4-phenylphenyl)aniline
CID 167038136
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)aniline
CID 146578337
2-(4-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline
CID 121329642
N-(4-naphthalen-1-ylphenyl)-2-[3-(9-phenylcarbazol-4-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167196149
N-(4-naphthalen-1-ylphenyl)-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]dibenzofuran-1-amine
CID 146360098
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-1-amine
CID 167195242
4-(4-carbazol-9-ylphenyl)-N,N-diphenylaniline;4-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-phenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N,4-diphenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-2-amine
CID 159528912
N-phenyl-N-[4-[4-[1-(2-phenylphenyl)benzo[c]carbazol-7-yl]phenyl]phenyl]naphthalen-1-amine
CID 177101002
N,N-bis[4-(4-carbazol-9-ylphenyl)phenyl]-2-phenylaniline;2-phenyl-N,N-bis[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;2-phenyl-N,N-bis[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 158204517
N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;9-phenylcarbazole
CID 158239659
7-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)benzo[c]carbazol-5-amine
CID 145362464

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline?
The IUPAC name of N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline (CID 158842849) is N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline?
The canonical SMILES for N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-n4c5ccccc5c5c6ccccc6n(-c6ccccc6)c54)cc3)cc2)cc1.c1ccc(-c2ccccc2N(c2ccc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc2)c2cccc3ccccc23)cc1.c1ccc(N(c2ccccc2)c2ccc(-n3c4ccccc4c4c5ccccc5n(-c5ccccc5)c43)cc2)cc1.
What is the InChIKey of N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline?
The InChIKey is IYLQFHBSZWPAOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H35N3.C48H33N3.C38H27N3/c1-4-14-36(15-5-1)38-24-28-41(29-25-38)51(42-30-26-39(27-31-42)37-16-6-2-7-17-37)43-32-34-44(35-33-43)53-48-23-13-11-21-46(48)49-45-20-10-12-22-47(45)52(50(49)53)40-18-8-3-9-19-40;1-3-16-34(17-4-1)39-23-9-12-26-43(39)49(44-29-15-19-35-18-7-8-22-40(35)44)37-30-32-38(33-31-37)51-46-28-14-11-25-42(46)47-41-24-10-13-27-45(41)50(48(47)51)36-20-5-2-6-21-36;1-4-14-28(15-5-1)39(29-16-6-2-7-17-29)31-24-26-32(27-25-31)41-36-23-13-11-21-34(36)37-33-20-10-12-22-35(33)40(38(37)41)30-18-8-3-9-19-30/h1-35H;1-33H;1-27H.
What are the key properties of N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline?
N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline has a molecular weight of 1855.32 g/mol, XLogP of 36.75, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-4-(6-phenylindolo[2,3-b]indol-5-yl)aniline;N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine;4-phenyl-N-[4-(6-phenylindolo[2,3-b]indol-5-yl)phenyl]-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 158842849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).