5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine

C56H37NO — CID 176765192

IUPAC5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)c(-c3ccc5ccccc5c3)cc3oc5ccccc5c34)c3ccccc3-c3cccc(-c4ccccc4)c3)cc2)cc1
InChIInChI=1S/C56H37NO/c1-3-14-38(15-4-1)41-28-30-46(31-29-41)57(53-24-11-9-22-48(53)44-21-13-20-43(34-44)39-16-5-2-6-17-39)47-32-33-49-52(36-47)51(45-27-26-40-18-7-8-19-42(40)35-45)37-55-56(49)50-23-10-12-25-54(50)58-55/h1-37H
InChIKeyUYHXKDWXQZIMGV-UHFFFAOYSA-N
MW739.92 g/mol
LogP16.03
Rot. Bonds7

About 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine

5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine (PubChem CID 176765192) has the molecular formula C56H37NO and a molecular weight of 739.92 g/mol. Its IUPAC name is 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine.

Molecular Properties

Compound Name5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine
PubChem CID176765192
Molecular FormulaC56H37NO
Molecular Weight739.92 g/mol
Exact Mass739.29
IUPAC Name5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)c(-c3ccc5ccccc5c3)cc3oc5ccccc5c34)c3ccccc3-c3cccc(-c4ccccc4)c3)cc2)cc1
InChIInChI=1S/C56H37NO/c1-3-14-38(15-4-1)41-28-30-46(31-29-41)57(53-24-11-9-22-48(53)44-21-13-20-43(34-44)39-16-5-2-6-17-39)47-32-33-49-52(36-47)51(45-27-26-40-18-7-8-19-42(40)35-45)37-55-56(49)50-23-10-12-25-54(50)58-55/h1-37H
InChIKeyUYHXKDWXQZIMGV-UHFFFAOYSA-N
XLogP16.03
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500739.92
LogP ≤ 516.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-naphthalen-2-yl-N-(4-naphtho[2,1-b][1]benzofuran-2-ylphenyl)-N-(4-phenylphenyl)aniline
CID 170030274
N-(3-dibenzofuran-1-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-2-phenylaniline
CID 170535022
5-naphthalen-2-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-2-amine
CID 176765183
N-(4-naphtho[2,1-b][1]benzofuran-4-ylphenyl)-N-(2-phenylphenyl)naphthalen-2-amine
CID 170031061
N-(4-dibenzofuran-3-ylphenyl)-N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-2-phenylaniline
CID 166565627
N-(4-naphtho[2,1-b][1]benzofuran-5-ylphenyl)-N-(2-phenylphenyl)phenanthren-3-amine
CID 170031062
N-dibenzofuran-1-yl-N-(4-phenanthren-3-ylphenyl)-5-phenylnaphtho[2,1-b][1]benzofuran-3-amine
CID 176765441
N-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-9-(3-phenylphenyl)dibenzofuran-2-amine
CID 166055468
N-(4-dibenzofuran-3-ylphenyl)-N-[4-[4-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-2-(2-phenylphenyl)aniline
CID 166565866
N-[4-(5-naphthalen-2-ylnaphtho[2,1-b][1]benzofuran-2-yl)phenyl]-N,3-diphenylaniline
CID 176765144
N-(4-naphtho[2,1-b][1]benzofuran-2-ylphenyl)-6-phenyl-N-(2-phenylphenyl)naphthalen-2-amine
CID 170126967
N-(4-dibenzofuran-1-ylphenyl)-N-[3-(4-naphthalen-2-ylphenyl)phenyl]-2-phenanthren-2-ylaniline
CID 176810690

Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine?
The IUPAC name of 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine (CID 176765192) is 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine.
What is the SMILES notation for 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine?
The canonical SMILES for 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)c(-c3ccc5ccccc5c3)cc3oc5ccccc5c34)c3ccccc3-c3cccc(-c4ccccc4)c3)cc2)cc1.
What is the InChIKey of 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine?
The InChIKey is UYHXKDWXQZIMGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H37NO/c1-3-14-38(15-4-1)41-28-30-46(31-29-41)57(53-24-11-9-22-48(53)44-21-13-20-43(34-44)39-16-5-2-6-17-39)47-32-33-49-52(36-47)51(45-27-26-40-18-7-8-19-42(40)35-45)37-55-56(49)50-23-10-12-25-54(50)58-55/h1-37H.
What are the key properties of 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine?
5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine has a molecular weight of 739.92 g/mol, XLogP of 16.03, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(3-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine is sourced from PubChem (CID 176765192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).