N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine

C64H44N4 — CID 153449161

IUPACN,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine
SMILESc1ccc(N2c3ccccc3N(c3ccccc3)c3c2c2c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-c5cccc6ccccc56)cc4)cccc2n3-c2ccccc2)cc1
InChIInChI=1S/C64H44N4/c1-4-23-49(24-5-1)66-58-33-14-15-34-59(58)67(50-25-6-2-7-26-50)64-63(66)62-60(35-18-36-61(62)68(64)51-27-8-3-9-28-51)65(52-41-37-47(38-42-52)56-31-16-21-45-19-10-12-29-54(45)56)53-43-39-48(40-44-53)57-32-17-22-46-20-11-13-30-55(46)57/h1-44H
InChIKeyHFJDFZZDQDVMNK-UHFFFAOYSA-N
MW869.08 g/mol
LogP17.99
Rot. Bonds8

About N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine

N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine (PubChem CID 153449161) has the molecular formula C64H44N4 and a molecular weight of 869.08 g/mol. Its IUPAC name is N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine.

Molecular Properties

Compound NameN,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine
PubChem CID153449161
Molecular FormulaC64H44N4
Molecular Weight869.08 g/mol
Exact Mass868.36
IUPAC NameN,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine
SMILESc1ccc(N2c3ccccc3N(c3ccccc3)c3c2c2c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-c5cccc6ccccc56)cc4)cccc2n3-c2ccccc2)cc1
InChIInChI=1S/C64H44N4/c1-4-23-49(24-5-1)66-58-33-14-15-34-59(58)67(50-25-6-2-7-26-50)64-63(66)62-60(35-18-36-61(62)68(64)51-27-8-3-9-28-51)65(52-41-37-47(38-42-52)56-31-16-21-45-19-10-12-29-54(45)56)53-43-39-48(40-44-53)57-32-17-22-46-20-11-13-30-55(46)57/h1-44H
InChIKeyHFJDFZZDQDVMNK-UHFFFAOYSA-N
XLogP17.99
TPSA14.65 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500869.08
LogP ≤ 517.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11,11-tetraphenylindolo[2,3-b][1,4]benzazasilin-1-amine
CID 153449220
N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(5,6,11-triphenylindolo[3,2-b]quinoxalin-10-yl)phenyl]dibenzofuran-1-amine;4-phenyl-N-[4-(2-phenylphenyl)phenyl]-N-[4-[4-(5,6,11-triphenylindolo[3,2-b]quinoxalin-10-yl)phenyl]phenyl]aniline;N,9,9-triphenyl-N-[3-(5,6,11-triphenylindolo[3,2-b]quinoxalin-10-yl)phenyl]fluoren-2-amine
CID 158067272
N-(4-naphthalen-1-ylphenyl)-9-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]carbazol-4-amine
CID 168835696
N,N-bis(4-naphthalen-1-ylphenyl)-5,6-diphenylindolo[3,2-b][1,4]benzothiazin-10-amine;N-[4-(5,6-diphenylindolo[3,2-b][1,4]benzothiazin-10-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-1-amine;N-(4-naphthalen-1-ylphenyl)-5,6-diphenyl-N-[4-(4-phenylphenyl)phenyl]indolo[3,2-b][1,4]benzothiazin-10-amine
CID 161267862
N-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-4-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)aniline
CID 170303156
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(4-naphthalen-1-ylphenyl)naphthalen-1-amine
CID 139339073
N-(4-naphthalen-1-ylphenyl)-2-[3-(9-phenylcarbazol-4-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167196149
N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169009927
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-1-amine
CID 167195242
N-(4-carbazol-9-ylphenyl)-9-naphthalen-1-yl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]carbazol-4-amine
CID 170379906
N,N-bis(4-naphthalen-1-ylphenyl)-5,6-diphenylindolo[3,2-b][1,4]benzoxazin-3-amine;5,6-diphenyl-N,N-bis(4-phenylphenyl)indolo[3,2-b][1,4]benzoxazin-3-amine
CID 160882826
N-[4-(6-phenylindolo[3,2-b][1,4]benzoxazin-5-yl)phenyl]-N-(2-phenylphenyl)naphthalen-1-amine
CID 146360107

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine?
The IUPAC name of N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine (CID 153449161) is N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine.
What is the SMILES notation for N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine?
The canonical SMILES for N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine is c1ccc(N2c3ccccc3N(c3ccccc3)c3c2c2c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-c5cccc6ccccc56)cc4)cccc2n3-c2ccccc2)cc1.
What is the InChIKey of N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine?
The InChIKey is HFJDFZZDQDVMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H44N4/c1-4-23-49(24-5-1)66-58-33-14-15-34-59(58)67(50-25-6-2-7-26-50)64-63(66)62-60(35-18-36-61(62)68(64)51-27-8-3-9-28-51)65(52-41-37-47(38-42-52)56-31-16-21-45-19-10-12-29-54(45)56)53-43-39-48(40-44-53)57-32-17-22-46-20-11-13-30-55(46)57/h1-44H.
What are the key properties of N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine?
N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine has a molecular weight of 869.08 g/mol, XLogP of 17.99, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-naphthalen-1-ylphenyl)-5,6,11-triphenylindolo[3,2-b]quinoxalin-10-amine is sourced from PubChem (CID 153449161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).