N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline

C179H128N6 — CID 161242415

IUPACN-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline
SMILESc1ccc(-c2cccc(N(c3ccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(N(c5ccc(C(c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5ccc6ccccc6c5)c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(N(c5ccc(C(c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5cccc6ccccc56)c4)ccc32)cc1
InChIInChI=1S/C61H44N2.2C59H42N2/c1-6-20-45(21-7-1)46-22-18-32-55(42-46)62(54-39-37-52(38-40-54)61(49-24-8-2-9-25-49,50-26-10-3-11-27-50)51-28-12-4-13-29-51)56-33-19-23-47(43-56)48-36-41-60-58(44-48)57-34-16-17-35-59(57)63(60)53-30-14-5-15-31-53;1-5-22-46(23-6-1)59(47-24-7-2-8-25-47,48-26-9-3-10-27-48)49-36-38-51(39-37-49)60(56-34-18-20-43-19-13-14-31-53(43)56)52-30-17-21-44(41-52)45-35-40-58-55(42-45)54-32-15-16-33-57(54)61(58)50-28-11-4-12-29-50;1-5-21-47(22-6-1)59(48-23-7-2-8-24-48,49-25-9-3-10-26-49)50-34-37-52(38-35-50)60(54-36-32-43-18-13-14-19-44(43)40-54)53-29-17-20-45(41-53)46-33-39-58-56(42-46)55-30-15-16-31-57(55)61(58)51-27-11-4-12-28-51/h1-44H;2*1-42H
InChIKeyVAEMUAXUFKGGLE-UHFFFAOYSA-N
MW2363.03 g/mol
LogP46.88
Rot. Bonds28

About N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline

N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline (PubChem CID 161242415) has the molecular formula C179H128N6 and a molecular weight of 2363.03 g/mol. Its IUPAC name is N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline.

Molecular Properties

Compound NameN-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline
PubChem CID161242415
Molecular FormulaC179H128N6
Molecular Weight2363.03 g/mol
Exact Mass2361.02
IUPAC NameN-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline
SMILESc1ccc(-c2cccc(N(c3ccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(N(c5ccc(C(c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5ccc6ccccc6c5)c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(N(c5ccc(C(c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5cccc6ccccc56)c4)ccc32)cc1
InChIInChI=1S/C61H44N2.2C59H42N2/c1-6-20-45(21-7-1)46-22-18-32-55(42-46)62(54-39-37-52(38-40-54)61(49-24-8-2-9-25-49,50-26-10-3-11-27-50)51-28-12-4-13-29-51)56-33-19-23-47(43-56)48-36-41-60-58(44-48)57-34-16-17-35-59(57)63(60)53-30-14-5-15-31-53;1-5-22-46(23-6-1)59(47-24-7-2-8-25-47,48-26-9-3-10-27-48)49-36-38-51(39-37-49)60(56-34-18-20-43-19-13-14-31-53(43)56)52-30-17-21-44(41-52)45-35-40-58-55(42-45)54-32-15-16-33-57(54)61(58)50-28-11-4-12-29-50;1-5-21-47(22-6-1)59(48-23-7-2-8-24-48,49-25-9-3-10-26-49)50-34-37-52(38-35-50)60(54-36-32-43-18-13-14-19-44(43)40-54)53-29-17-20-45(41-53)46-33-39-58-56(42-46)55-30-15-16-31-57(55)61(58)51-27-11-4-12-28-51/h1-44H;2*1-42H
InChIKeyVAEMUAXUFKGGLE-UHFFFAOYSA-N
XLogP46.88
TPSA24.51 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds28
Heavy Atoms185
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002363.03
LogP ≤ 546.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline?
The IUPAC name of N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline (CID 161242415) is N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline.
What is the SMILES notation for N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline?
The canonical SMILES for N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline is c1ccc(-c2cccc(N(c3ccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(N(c5ccc(C(c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5ccc6ccccc6c5)c4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(N(c5ccc(C(c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5cccc6ccccc56)c4)ccc32)cc1.
What is the InChIKey of N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline?
The InChIKey is VAEMUAXUFKGGLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H44N2.2C59H42N2/c1-6-20-45(21-7-1)46-22-18-32-55(42-46)62(54-39-37-52(38-40-54)61(49-24-8-2-9-25-49,50-26-10-3-11-27-50)51-28-12-4-13-29-51)56-33-19-23-47(43-56)48-36-41-60-58(44-48)57-34-16-17-35-59(57)63(60)53-30-14-5-15-31-53;1-5-22-46(23-6-1)59(47-24-7-2-8-25-47,48-26-9-3-10-27-48)49-36-38-51(39-37-49)60(56-34-18-20-43-19-13-14-31-53(43)56)52-30-17-21-44(41-52)45-35-40-58-55(42-45)54-32-15-16-33-57(54)61(58)50-28-11-4-12-29-50;1-5-21-47(22-6-1)59(48-23-7-2-8-24-48,49-25-9-3-10-26-49)50-34-37-52(38-35-50)60(54-36-32-43-18-13-14-19-44(43)40-54)53-29-17-20-45(41-53)46-33-39-58-56(42-46)55-30-15-16-31-57(55)61(58)51-27-11-4-12-28-51/h1-44H;2*1-42H.
What are the key properties of N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline?
N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline has a molecular weight of 2363.03 g/mol, XLogP of 46.88, 28 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-1-amine;N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine;3-phenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline is sourced from PubChem (CID 161242415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).