N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline

C116H82N2 — CID 158592515

IUPACN-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc3-c3cccc(-c4ccccc4)c3)cc2)cc1.c1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc3-c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/2C58H41N/c1-4-14-42(15-5-1)45-26-28-49(29-27-45)58-41-54(38-39-57(58)51-23-12-22-50(40-51)44-18-8-3-9-19-44)59(52-34-30-46(31-35-52)43-16-6-2-7-17-43)53-36-32-48(33-37-53)56-25-13-21-47-20-10-11-24-55(47)56;1-4-15-42(16-5-1)44-27-29-49(30-28-44)58-41-52(39-40-57(58)56-25-13-12-24-55(56)46-19-8-3-9-20-46)59(50-35-31-45(32-36-50)43-17-6-2-7-18-43)51-37-33-48(34-38-51)54-26-14-22-47-21-10-11-23-53(47)54/h2*1-41H
InChIKeyHUPQHNMAQAKXKY-UHFFFAOYSA-N
MW1503.95 g/mol
LogP32.62
Rot. Bonds18

About N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline

N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline (PubChem CID 158592515) has the molecular formula C116H82N2 and a molecular weight of 1503.95 g/mol. Its IUPAC name is N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline
PubChem CID158592515
Molecular FormulaC116H82N2
Molecular Weight1503.95 g/mol
Exact Mass1502.65
IUPAC NameN-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc3-c3cccc(-c4ccccc4)c3)cc2)cc1.c1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc3-c3ccccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/2C58H41N/c1-4-14-42(15-5-1)45-26-28-49(29-27-45)58-41-54(38-39-57(58)51-23-12-22-50(40-51)44-18-8-3-9-19-44)59(52-34-30-46(31-35-52)43-16-6-2-7-17-43)53-36-32-48(33-37-53)56-25-13-21-47-20-10-11-24-55(47)56;1-4-15-42(16-5-1)44-27-29-49(30-28-44)58-41-52(39-40-57(58)56-25-13-12-24-55(56)46-19-8-3-9-20-46)59(50-35-31-45(32-36-50)43-17-6-2-7-18-43)51-37-33-48(34-38-51)54-26-14-22-47-21-10-11-23-53(47)54/h2*1-41H
InChIKeyHUPQHNMAQAKXKY-UHFFFAOYSA-N
XLogP32.62
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms118
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001503.95
LogP ≤ 532.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline with MolForge

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Related Compounds

N-(4-naphthalen-1-ylphenyl)-3-phenyl-N,4-bis(4-phenylphenyl)aniline
CID 121477367
N,N-bis(4-naphthalen-1-ylphenyl)-3,4-diphenylaniline;N,N-bis(4-naphthalen-1-ylphenyl)-3-phenyl-4-(4-phenylphenyl)aniline;N-(4-naphthalen-2-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline
CID 157345301
4-[4-(2,5-diphenylphenyl)phenyl]-N,N-bis(4-naphthalen-1-ylphenyl)aniline
CID 167297413
N-[4-(3,4-diphenylphenyl)phenyl]-N-(4-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)aniline
CID 164831821
3-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]aniline
CID 172501995
4-[4-[4-[6-[4-(4-naphthalen-2-yl-N-[4-(4-naphthalen-1-ylphenyl)-3-phenylphenyl]anilino)phenyl]naphthalen-1-yl]phenyl]phenyl]-N,N-bis(4-naphthalen-2-ylphenyl)-3-phenylaniline
CID 146496903
4-(3-benzo[c]phenanthren-1-ylphenyl)-N,3-diphenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 167183655
bis(3,5-diphenyl-N,N-bis(4-phenylphenyl)-4-[4-(N-(4-phenylphenyl)anilino)phenyl]aniline);N,3-diphenyl-N-(4-phenylphenyl)-4-[4-[3-(N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline;N-(4-naphthalen-1-ylphenyl)-3-phenyl-N-(4-phenylphenyl)-4-[4-(N-(4-phenylphenyl)anilino)phenyl]aniline;3-phenyl-N,N-bis(4-phenylphenyl)-4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]aniline
CID 158742458
4-naphthalen-1-yl-N,N-bis(4-naphthalen-1-yl-3-phenylphenyl)-3-phenylaniline
CID 122470453
N-[4-(3,5-diphenylphenyl)phenyl]-4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)aniline
CID 130353837
N-[4-(2,5-diphenylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline;N-[4-(2-naphthalen-1-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline;N-[4-(2-naphthalen-2-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 160767900
N-[4-[4-(N-(3,4-diphenylphenyl)-4-phenylanilino)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine;N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine;N-[4-(3-phenylphenyl)phenyl]-N-[4-[4-(4-phenyl-N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]naphthalen-1-amine
CID 159775461

Frequently Asked Questions

What is the IUPAC name of N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline?
The IUPAC name of N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline (CID 158592515) is N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline.
What is the SMILES notation for N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline?
The canonical SMILES for N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline is c1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc3-c3cccc(-c4ccccc4)c3)cc2)cc1.c1ccc(-c2ccc(-c3cc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc3-c3ccccc3-c3ccccc3)cc2)cc1.
What is the InChIKey of N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline?
The InChIKey is HUPQHNMAQAKXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C58H41N/c1-4-14-42(15-5-1)45-26-28-49(29-27-45)58-41-54(38-39-57(58)51-23-12-22-50(40-51)44-18-8-3-9-19-44)59(52-34-30-46(31-35-52)43-16-6-2-7-17-43)53-36-32-48(33-37-53)56-25-13-21-47-20-10-11-24-55(47)56;1-4-15-42(16-5-1)44-27-29-49(30-28-44)58-41-52(39-40-57(58)56-25-13-12-24-55(56)46-19-8-3-9-20-46)59(50-35-31-45(32-36-50)43-17-6-2-7-18-43)51-37-33-48(34-38-51)54-26-14-22-47-21-10-11-23-53(47)54/h2*1-41H.
What are the key properties of N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline?
N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline has a molecular weight of 1503.95 g/mol, XLogP of 32.62, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-naphthalen-1-ylphenyl)-4-(2-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline;N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)-N,3-bis(4-phenylphenyl)aniline is sourced from PubChem (CID 158592515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).