N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine

C54H37NO — CID 135277344

IUPACN,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(oc6ccccc65)c4-c4ccc(-c5ccccc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C54H37NO/c1-4-12-38(13-5-1)41-20-22-43(23-21-41)45-30-34-48(35-31-45)55(47-32-28-44(29-33-47)40-16-8-3-9-17-40)51-37-36-50-49-18-10-11-19-52(49)56-54(50)53(51)46-26-24-42(25-27-46)39-14-6-2-7-15-39/h1-37H
InChIKeyCXDWAAMZXBNMGH-UHFFFAOYSA-N
MW715.90 g/mol
LogP15.39
Rot. Bonds8

About N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine

N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine (PubChem CID 135277344) has the molecular formula C54H37NO and a molecular weight of 715.90 g/mol. Its IUPAC name is N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine.

Molecular Properties

Compound NameN,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
PubChem CID135277344
Molecular FormulaC54H37NO
Molecular Weight715.90 g/mol
Exact Mass715.29
IUPAC NameN,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(oc6ccccc65)c4-c4ccc(-c5ccccc5)cc4)cc3)cc2)cc1
InChIInChI=1S/C54H37NO/c1-4-12-38(13-5-1)41-20-22-43(23-21-41)45-30-34-48(35-31-45)55(47-32-28-44(29-33-47)40-16-8-3-9-17-40)51-37-36-50-49-18-10-11-19-52(49)56-54(50)53(51)46-26-24-42(25-27-46)39-14-6-2-7-15-39/h1-37H
InChIKeyCXDWAAMZXBNMGH-UHFFFAOYSA-N
XLogP15.39
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.90
LogP ≤ 515.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine
CID 135277582
N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 135277386
N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine;N,4-diphenyl-N-[4-[4-(4-phenylphenyl)dibenzofuran-3-yl]phenyl]aniline;N-phenyl-N,4-bis(4-phenylphenyl)dibenzofuran-3-amine;4-phenyl-N-[4-[4-(4-phenylphenyl)dibenzofuran-3-yl]phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)dibenzofuran-3-yl]phenyl]aniline;N-phenyl-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
CID 160729706
N-(4-dibenzofuran-4-ylphenyl)-10-phenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-9-amine
CID 170675432
4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenylphenyl)dibenzofuran-3-yl]phenyl]aniline
CID 135277346
4-methyl-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine
CID 157259668
4-(4-carbazol-9-ylphenyl)-N,N-diphenyldibenzofuran-3-amine
CID 176609874
4-naphthalen-2-yl-N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;N-[4-(4-naphthalen-2-yldibenzofuran-3-yl)phenyl]-N,4-diphenylaniline;N-[4-(4-naphthalen-2-yldibenzofuran-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(4-naphthalen-2-yldibenzofuran-3-yl)phenyl]-4-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline;4-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)dibenzofuran-3-amine;4-naphthalen-2-yl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine
CID 160597772
16-phenyl-N,N-bis(4-phenylphenyl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-17-amine
CID 171433561
N-phenyl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzofuran-4-amine
CID 71126595
N-[4-(9,10-diphenylphenanthren-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 169064652
N-(4-dibenzofuran-4-ylphenyl)-16-phenyl-N-(4-phenylphenyl)-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-17-amine
CID 171433536

Frequently Asked Questions

What is the IUPAC name of N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine?
The IUPAC name of N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine (CID 135277344) is N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine.
What is the SMILES notation for N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine?
The canonical SMILES for N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(oc6ccccc65)c4-c4ccc(-c5ccccc5)cc4)cc3)cc2)cc1.
What is the InChIKey of N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine?
The InChIKey is CXDWAAMZXBNMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H37NO/c1-4-12-38(13-5-1)41-20-22-43(23-21-41)45-30-34-48(35-31-45)55(47-32-28-44(29-33-47)40-16-8-3-9-17-40)51-37-36-50-49-18-10-11-19-52(49)56-54(50)53(51)46-26-24-42(25-27-46)39-14-6-2-7-15-39/h1-37H.
What are the key properties of N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine?
N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine has a molecular weight of 715.90 g/mol, XLogP of 15.39, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-3-amine is sourced from PubChem (CID 135277344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).