N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine

C52H33NO2 — CID 170301754

IUPACN-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cc4oc5cccc(N(c6ccccc6)c6ccc7c(c6)oc6ccccc67)c5c4c4ccccc34)c2)cc1
InChIInChI=1S/C52H33NO2/c1-4-15-34(16-5-1)36-29-37(35-17-6-2-7-18-35)31-38(30-36)45-33-50-51(44-23-11-10-21-41(44)45)52-46(24-14-26-48(52)55-50)53(39-19-8-3-9-20-39)40-27-28-43-42-22-12-13-25-47(42)54-49(43)32-40/h1-33H
InChIKeyQEOXSIMYNGEZEI-UHFFFAOYSA-N
MW703.84 g/mol
LogP15.11
Rot. Bonds6

About N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine

N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine (PubChem CID 170301754) has the molecular formula C52H33NO2 and a molecular weight of 703.84 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine
PubChem CID170301754
Molecular FormulaC52H33NO2
Molecular Weight703.84 g/mol
Exact Mass703.25
IUPAC NameN-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cc4oc5cccc(N(c6ccccc6)c6ccc7c(c6)oc6ccccc67)c5c4c4ccccc34)c2)cc1
InChIInChI=1S/C52H33NO2/c1-4-15-34(16-5-1)36-29-37(35-17-6-2-7-18-35)31-38(30-36)45-33-50-51(44-23-11-10-21-41(44)45)52-46(24-14-26-48(52)55-50)53(39-19-8-3-9-20-39)40-27-28-43-42-22-12-13-25-47(42)54-49(43)32-40/h1-33H
InChIKeyQEOXSIMYNGEZEI-UHFFFAOYSA-N
XLogP15.11
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500703.84
LogP ≤ 515.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-9-amine
CID 170301707
N-dibenzofuran-1-yl-N,5-diphenylnaphtho[2,1-b][1]benzofuran-11-amine
CID 170301528
N-[2-[2-(N-dibenzofuran-3-yl-4-phenylanilino)phenyl]phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 167086852
1-N-dibenzofuran-3-yl-1-N,7-N,7-N-triphenyldibenzofuran-1,7-diamine
CID 146573998
N-phenyl-5-(6-phenylnaphthalen-2-yl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-11-amine
CID 176808370
N-dibenzofuran-1-yl-5-phenyl-N-[4-(4-phenylphenyl)phenyl]naphtho[2,1-b][1]benzofuran-3-amine
CID 176765019
N-dibenzofuran-3-yl-N-[4-(3,5-diphenylphenyl)phenyl]dibenzofuran-3-amine
CID 70808582
3-N-dibenzofuran-3-yl-4,6-diphenyl-1-N,1-N,3-N-tris(4-phenylphenyl)benzene-1,3-diamine
CID 118603848
N-naphthalen-2-yl-5-phenyl-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-11-amine
CID 170301658
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-[3-(4-phenylphenyl)phenyl]phenyl]-N-[4-[4-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-3-amine
CID 121311288
N-[4-[4-(3-phenylphenyl)phenyl]phenyl]-N-[4-[4-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-3-amine
CID 121311323

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine?
The IUPAC name of N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine (CID 170301754) is N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine.
What is the SMILES notation for N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine?
The canonical SMILES for N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine is c1ccc(-c2cc(-c3ccccc3)cc(-c3cc4oc5cccc(N(c6ccccc6)c6ccc7c(c6)oc6ccccc67)c5c4c4ccccc34)c2)cc1.
What is the InChIKey of N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine?
The InChIKey is QEOXSIMYNGEZEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H33NO2/c1-4-15-34(16-5-1)36-29-37(35-17-6-2-7-18-35)31-38(30-36)45-33-50-51(44-23-11-10-21-41(44)45)52-46(24-14-26-48(52)55-50)53(39-19-8-3-9-20-39)40-27-28-43-42-22-12-13-25-47(42)54-49(43)32-40/h1-33H.
What are the key properties of N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine?
N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine has a molecular weight of 703.84 g/mol, XLogP of 15.11, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-5-(3,5-diphenylphenyl)-N-phenylnaphtho[2,1-b][1]benzofuran-11-amine is sourced from PubChem (CID 170301754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).