N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine

C70H47NO — CID 168847734

IUPACN-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3-c3ccc(N(c4ccc(-c5cccc(-c6ccc7ccccc7c6)c5)cc4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)cc3)c2)cc1
InChIInChI=1S/C70H47NO/c1-4-17-48(18-5-1)58-45-59(49-19-6-2-7-20-49)47-60(46-58)64-28-13-12-27-63(64)53-35-39-62(40-36-53)71(67-42-41-65(52-22-8-3-9-23-52)70-69(67)66-29-14-15-30-68(66)72-70)61-37-33-51(34-38-61)55-25-16-26-56(43-55)57-32-31-50-21-10-11-24-54(50)44-57/h1-47H
InChIKeyWHPIWIGJTWALHW-UHFFFAOYSA-N
MW918.15 g/mol
LogP19.88
Rot. Bonds10

About N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine

N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine (PubChem CID 168847734) has the molecular formula C70H47NO and a molecular weight of 918.15 g/mol. Its IUPAC name is N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine.

Molecular Properties

Compound NameN-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine
PubChem CID168847734
Molecular FormulaC70H47NO
Molecular Weight918.15 g/mol
Exact Mass917.37
IUPAC NameN-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3-c3ccc(N(c4ccc(-c5cccc(-c6ccc7ccccc7c6)c5)cc4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)cc3)c2)cc1
InChIInChI=1S/C70H47NO/c1-4-17-48(18-5-1)58-45-59(49-19-6-2-7-20-49)47-60(46-58)64-28-13-12-27-63(64)53-35-39-62(40-36-53)71(67-42-41-65(52-22-8-3-9-23-52)70-69(67)66-29-14-15-30-68(66)72-70)61-37-33-51(34-38-61)55-25-16-26-56(43-55)57-32-31-50-21-10-11-24-54(50)44-57/h1-47H
InChIKeyWHPIWIGJTWALHW-UHFFFAOYSA-N
XLogP19.88
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500918.15
LogP ≤ 519.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-naphthalen-2-ylphenyl)-4-phenyl-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069839
N-[4-(3-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(2-naphthalen-2-ylphenyl)phenyl]phenyl]-4-phenyldibenzofuran-1-amine
CID 168847972
N-(4-naphthalen-2-ylphenyl)-N-[4-[2-(2-naphthalen-1-ylphenyl)phenyl]phenyl]-4-phenyldibenzofuran-1-amine
CID 168847874
4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)-N-[2-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069341
N-[4-(3-naphthalen-1-ylphenyl)phenyl]-4-phenyl-N-[4-[2-(4-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 168848045
N-[4-(3-naphthalen-1-ylphenyl)phenyl]-4-phenyl-N-[4-[2-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 168847695
4-naphthalen-2-yl-N-phenyl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069342
4-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069338
4-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069663
4-naphthalen-2-yl-N-(3-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069783
4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069895
4-naphthalen-2-yl-N-(3-naphthalen-1-ylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069235

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine?
The IUPAC name of N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine (CID 168847734) is N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine.
What is the SMILES notation for N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine?
The canonical SMILES for N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine is c1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3-c3ccc(N(c4ccc(-c5cccc(-c6ccc7ccccc7c6)c5)cc4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)cc3)c2)cc1.
What is the InChIKey of N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine?
The InChIKey is WHPIWIGJTWALHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H47NO/c1-4-17-48(18-5-1)58-45-59(49-19-6-2-7-20-49)47-60(46-58)64-28-13-12-27-63(64)53-35-39-62(40-36-53)71(67-42-41-65(52-22-8-3-9-23-52)70-69(67)66-29-14-15-30-68(66)72-70)61-37-33-51(34-38-61)55-25-16-26-56(43-55)57-32-31-50-21-10-11-24-54(50)44-57/h1-47H.
What are the key properties of N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine?
N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine has a molecular weight of 918.15 g/mol, XLogP of 19.88, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(3,5-diphenylphenyl)phenyl]phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-4-phenyldibenzofuran-1-amine is sourced from PubChem (CID 168847734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).