N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine

C48H33NO — CID 121287876

IUPACN-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3c(-c4ccccc4)cc(-c4ccccc4)cc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C48H33NO/c1-5-15-34(16-6-1)36-25-27-40(28-26-36)49(41-29-30-43-42-23-13-14-24-46(42)50-47(43)33-41)48-44(37-19-9-3-10-20-37)31-39(35-17-7-2-8-18-35)32-45(48)38-21-11-4-12-22-38/h1-33H
InChIKeyZZPGXGZUCGFREM-UHFFFAOYSA-N
MW639.80 g/mol
LogP13.72
Rot. Bonds7

About N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine

N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine (PubChem CID 121287876) has the molecular formula C48H33NO and a molecular weight of 639.80 g/mol. Its IUPAC name is N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine.

Molecular Properties

Compound NameN-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine
PubChem CID121287876
Molecular FormulaC48H33NO
Molecular Weight639.80 g/mol
Exact Mass639.26
IUPAC NameN-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3c(-c4ccccc4)cc(-c4ccccc4)cc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C48H33NO/c1-5-15-34(16-6-1)36-25-27-40(28-26-36)49(41-29-30-43-42-23-13-14-24-46(42)50-47(43)33-41)48-44(37-19-9-3-10-20-37)31-39(35-17-7-2-8-18-35)32-45(48)38-21-11-4-12-22-38/h1-33H
InChIKeyZZPGXGZUCGFREM-UHFFFAOYSA-N
XLogP13.72
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500639.80
LogP ≤ 513.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-dibenzofuran-3-yl-N-[4-(3,5-diphenylphenyl)phenyl]dibenzofuran-3-amine
CID 70808582
N,N-bis(4-phenylphenyl)dibenzofuran-3-amine
CID 121311287
N-(2,6-diphenylphenyl)-N-phenyldibenzofuran-3-amine
CID 121287858
N-(4-phenylphenyl)-N-[4-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-3-amine
CID 172501001
N-[4-[2,5-diphenyl-4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-3-amine
CID 176611362
3-N-dibenzofuran-3-yl-4,6-diphenyl-1-N,1-N,3-N-tris(4-phenylphenyl)benzene-1,3-diamine
CID 118603848
N-(4-phenylphenyl)-N-[2-phenyl-4-(3-phenylphenyl)phenyl]dibenzofuran-3-amine
CID 155122912
N-[4-[3-(4-phenylphenyl)phenyl]phenyl]-N-[4-[4-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-3-amine
CID 121311288
N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;N,N-bis(4-phenylphenyl)dibenzofuran-3-amine;4-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 157238587
N-(4-phenylphenyl)-N-[4-[3-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-3-amine;N-(4-phenylphenyl)-N-[4-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-3-amine
CID 160832647
N-[4-[4-(3-phenylphenyl)phenyl]phenyl]-N-[4-[4-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-3-amine
CID 121311323
N-dibenzofuran-3-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)naphthalen-1-yl]phenyl]dibenzofuran-3-amine
CID 71126774

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine?
The IUPAC name of N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine (CID 121287876) is N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine.
What is the SMILES notation for N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine?
The canonical SMILES for N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine is c1ccc(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3c(-c4ccccc4)cc(-c4ccccc4)cc3-c3ccccc3)cc2)cc1.
What is the InChIKey of N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine?
The InChIKey is ZZPGXGZUCGFREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H33NO/c1-5-15-34(16-6-1)36-25-27-40(28-26-36)49(41-29-30-43-42-23-13-14-24-46(42)50-47(43)33-41)48-44(37-19-9-3-10-20-37)31-39(35-17-7-2-8-18-35)32-45(48)38-21-11-4-12-22-38/h1-33H.
What are the key properties of N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine?
N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine has a molecular weight of 639.80 g/mol, XLogP of 13.72, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylphenyl)-N-(2,4,6-triphenylphenyl)dibenzofuran-3-amine is sourced from PubChem (CID 121287876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).