5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline

C50H35N — CID 167236266

IUPAC5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline
SMILESc1ccc(-c2cccc(N(c3cccc(-c4cccc5ccccc45)c3)c3cc(-c4cccc5ccccc45)ccc3-c3ccccc3)c2)cc1
InChIInChI=1S/C50H35N/c1-3-15-36(16-4-1)40-23-11-25-43(33-40)51(44-26-12-24-41(34-44)47-29-13-21-37-19-7-9-27-45(37)47)50-35-42(31-32-49(50)39-17-5-2-6-18-39)48-30-14-22-38-20-8-10-28-46(38)48/h1-35H
InChIKeyQCNICFVVKZZPMH-UHFFFAOYSA-N
MW649.84 g/mol
LogP14.13
Rot. Bonds7

About 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline

5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline (PubChem CID 167236266) has the molecular formula C50H35N and a molecular weight of 649.84 g/mol. Its IUPAC name is 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline.

Molecular Properties

Compound Name5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline
PubChem CID167236266
Molecular FormulaC50H35N
Molecular Weight649.84 g/mol
Exact Mass649.28
IUPAC Name5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline
SMILESc1ccc(-c2cccc(N(c3cccc(-c4cccc5ccccc45)c3)c3cc(-c4cccc5ccccc45)ccc3-c3ccccc3)c2)cc1
InChIInChI=1S/C50H35N/c1-3-15-36(16-4-1)40-23-11-25-43(33-40)51(44-26-12-24-41(34-44)47-29-13-21-37-19-7-9-27-45(37)47)50-35-42(31-32-49(50)39-17-5-2-6-18-39)48-30-14-22-38-20-8-10-28-46(38)48/h1-35H
InChIKeyQCNICFVVKZZPMH-UHFFFAOYSA-N
XLogP14.13
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500649.84
LogP ≤ 514.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-naphthalen-1-yl-2-phenyl-N-(3-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 167236259
5-naphthalen-2-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline
CID 167235718
5-naphthalen-1-yl-N-[4-(3-naphthalen-1-ylphenyl)phenyl]-N,2-diphenylaniline
CID 167236235
2-(3-naphthalen-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-5-phenyl-N-(4-phenylphenyl)aniline
CID 174305065
5-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)-N,2-diphenylaniline
CID 167236233
N-(3-naphthalen-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-2-(3-phenylphenyl)aniline
CID 167324175
N-(3-naphthalen-1-ylphenyl)-N,2-bis(3-phenylphenyl)aniline
CID 167324216
N-(3-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 167324300
5-naphthalen-2-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 167235721
N-(3-naphthalen-1-ylphenyl)-N-(3-phenylphenyl)-2-[2-(2-phenylphenyl)phenyl]aniline
CID 172501661
N-(3-naphthalen-1-ylphenyl)-3,5-diphenyl-N-(2-phenylphenyl)aniline
CID 167324104
N-(5-naphthalen-1-yl-2-phenylphenyl)-4-phenyl-N-(4-phenylphenyl)naphthalen-1-amine
CID 167235524

Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline?
The IUPAC name of 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline (CID 167236266) is 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline.
What is the SMILES notation for 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline?
The canonical SMILES for 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline is c1ccc(-c2cccc(N(c3cccc(-c4cccc5ccccc45)c3)c3cc(-c4cccc5ccccc45)ccc3-c3ccccc3)c2)cc1.
What is the InChIKey of 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline?
The InChIKey is QCNICFVVKZZPMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H35N/c1-3-15-36(16-4-1)40-23-11-25-43(33-40)51(44-26-12-24-41(34-44)47-29-13-21-37-19-7-9-27-45(37)47)50-35-42(31-32-49(50)39-17-5-2-6-18-39)48-30-14-22-38-20-8-10-28-46(38)48/h1-35H.
What are the key properties of 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline?
5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline has a molecular weight of 649.84 g/mol, XLogP of 14.13, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-(3-phenylphenyl)aniline is sourced from PubChem (CID 167236266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).