2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline

C60H41N — CID 167235748

IUPAC2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline
SMILESc1ccc(-c2ccccc2N(c2ccc(-c3cccc(-c4ccc5ccccc5c4)c3)cc2)c2cc(-c3ccc4ccccc4c3)ccc2-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C60H41N/c1-2-16-46(17-3-1)57-23-10-11-24-59(57)61(56-34-31-45(32-35-56)50-21-12-22-51(37-50)52-28-25-42-13-4-7-18-47(42)38-52)60-41-54(53-29-26-43-14-5-8-19-48(43)39-53)33-36-58(60)55-30-27-44-15-6-9-20-49(44)40-55/h1-41H
InChIKeyPWQDYWRZAKZKNI-UHFFFAOYSA-N
MW776.00 g/mol
LogP16.95
Rot. Bonds8

About 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline

2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline (PubChem CID 167235748) has the molecular formula C60H41N and a molecular weight of 776.00 g/mol. Its IUPAC name is 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline.

Molecular Properties

Compound Name2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline
PubChem CID167235748
Molecular FormulaC60H41N
Molecular Weight776.00 g/mol
Exact Mass775.32
IUPAC Name2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline
SMILESc1ccc(-c2ccccc2N(c2ccc(-c3cccc(-c4ccc5ccccc5c4)c3)cc2)c2cc(-c3ccc4ccccc4c3)ccc2-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C60H41N/c1-2-16-46(17-3-1)57-23-10-11-24-59(57)61(56-34-31-45(32-35-56)50-21-12-22-51(37-50)52-28-25-42-13-4-7-18-47(42)38-52)60-41-54(53-29-26-43-14-5-8-19-48(43)39-53)33-36-58(60)55-30-27-44-15-6-9-20-49(44)40-55/h1-41H
InChIKeyPWQDYWRZAKZKNI-UHFFFAOYSA-N
XLogP16.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500776.00
LogP ≤ 516.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(3,5-diphenylphenyl)phenyl]-2,5-dinaphthalen-2-yl-N-(2-phenylphenyl)aniline
CID 167235492
N-[4-(3,5-diphenylphenyl)phenyl]-5-naphthalen-2-yl-2-phenyl-N-(2-phenylphenyl)aniline
CID 167233900
N-(2,5-dinaphthalen-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 167235752
5-naphthalen-2-yl-N,N-bis(4-naphthalen-2-ylphenyl)-2-phenylaniline
CID 167235732
N-(3-naphthalen-2-ylphenyl)-N-[4-(2-naphthalen-2-ylphenyl)phenyl]-2-(4-phenylphenyl)aniline
CID 167271677
2-naphthalen-2-yl-N-(3-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]aniline
CID 167271683
5-naphthalen-2-yl-N-(3-naphthalen-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-2-phenylaniline
CID 167235736
N-[4-[4-(2,5-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-2-ylphenyl)-2-phenylaniline
CID 167297415
5-naphthalen-2-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 167235721
N-[4-(3-carbazol-9-ylphenyl)phenyl]-2,5-dinaphthalen-2-yl-N-(2-phenylphenyl)aniline
CID 167234428
5-naphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(4-phenanthren-2-ylphenyl)-2-phenylaniline
CID 167235270
1-N-[4-(6-naphthalen-1-ylnaphthalen-2-yl)phenyl]-1-N-phenyl-4-N,4-N-bis(2-phenylphenyl)benzene-1,4-diamine
CID 176587601

Frequently Asked Questions

What is the IUPAC name of 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline?
The IUPAC name of 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline (CID 167235748) is 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline.
What is the SMILES notation for 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline?
The canonical SMILES for 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline is c1ccc(-c2ccccc2N(c2ccc(-c3cccc(-c4ccc5ccccc5c4)c3)cc2)c2cc(-c3ccc4ccccc4c3)ccc2-c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline?
The InChIKey is PWQDYWRZAKZKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H41N/c1-2-16-46(17-3-1)57-23-10-11-24-59(57)61(56-34-31-45(32-35-56)50-21-12-22-51(37-50)52-28-25-42-13-4-7-18-47(42)38-52)60-41-54(53-29-26-43-14-5-8-19-48(43)39-53)33-36-58(60)55-30-27-44-15-6-9-20-49(44)40-55/h1-41H.
What are the key properties of 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline?
2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline has a molecular weight of 776.00 g/mol, XLogP of 16.95, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline is sourced from PubChem (CID 167235748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).