N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine

C56H36N2O — CID 168809159

IUPACN-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cc(-n5c6ccccc6c6ccccc65)cc5ccccc45)cc3)c3ccc4oc5ccccc5c4c3)c3ccccc23)cc1
InChIInChI=1S/C56H36N2O/c1-2-14-37(15-3-1)44-31-32-54(46-19-7-6-18-45(44)46)57(41-30-33-56-51(35-41)49-22-10-13-25-55(49)59-56)40-28-26-38(27-29-40)50-36-42(34-39-16-4-5-17-43(39)50)58-52-23-11-8-20-47(52)48-21-9-12-24-53(48)58/h1-36H
InChIKeyQDIQPNHDAPQDJS-UHFFFAOYSA-N
MW752.92 g/mol
LogP15.79
Rot. Bonds6

About N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine

N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine (PubChem CID 168809159) has the molecular formula C56H36N2O and a molecular weight of 752.92 g/mol. Its IUPAC name is N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine.

Molecular Properties

Compound NameN-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine
PubChem CID168809159
Molecular FormulaC56H36N2O
Molecular Weight752.92 g/mol
Exact Mass752.28
IUPAC NameN-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4cc(-n5c6ccccc6c6ccccc65)cc5ccccc45)cc3)c3ccc4oc5ccccc5c4c3)c3ccccc23)cc1
InChIInChI=1S/C56H36N2O/c1-2-14-37(15-3-1)44-31-32-54(46-19-7-6-18-45(44)46)57(41-30-33-56-51(35-41)49-22-10-13-25-55(49)59-56)40-28-26-38(27-29-40)50-36-42(34-39-16-4-5-17-43(39)50)58-52-23-11-8-20-47(52)48-21-9-12-24-53(48)58/h1-36H
InChIKeyQDIQPNHDAPQDJS-UHFFFAOYSA-N
XLogP15.79
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500752.92
LogP ≤ 515.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[4-(N-dibenzofuran-2-yl-4-phenylanilino)phenyl]naphthalen-1-yl]-N,9-diphenylcarbazol-2-amine
CID 171057527
N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-2-amine
CID 58510687
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(5-naphthalen-1-yl-2-phenylphenyl)dibenzofuran-2-amine
CID 167234931
N-(3-carbazol-9-ylnaphthalen-1-yl)-N-dibenzofuran-2-yldibenzofuran-2-amine
CID 168809194
N-[3-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 168809217
N-(4-naphthalen-1-ylphenyl)-4-phenyl-N-[4-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]aniline;N-(4-phenylphenyl)-N-[4-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]phenyl]naphthalen-1-amine
CID 158555584
N-naphtho[2,3-b][1]benzofuran-3-yl-9-phenyl-N-(4-phenylnaphthalen-1-yl)carbazol-3-amine
CID 163903640
N-(4-carbazol-9-ylnaphthalen-1-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]dibenzofuran-2-amine
CID 71038542
4-[4-(4-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)anilino)phenyl]-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;4-N-(4-carbazol-9-ylphenyl)-4-N-(4-dibenzofuran-2-ylphenyl)-1-N,1-N-diphenylnaphthalene-1,4-diamine;4-[4-(4-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]-N,N-bis[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-[4-(4-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]-9-phenyl-N-(9-phenylcarbazol-3-yl)carbazol-3-amine
CID 157190055
N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 168809283
N-(4-carbazol-9-ylphenyl)-N-[4-(4-phenanthren-9-ylphenyl)phenyl]-4-(4-phenylphenyl)naphthalen-1-amine
CID 146580920
N-dibenzofuran-4-yl-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine
CID 58510678

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine?
The IUPAC name of N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine (CID 168809159) is N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine.
What is the SMILES notation for N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine?
The canonical SMILES for N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine is c1ccc(-c2ccc(N(c3ccc(-c4cc(-n5c6ccccc6c6ccccc65)cc5ccccc45)cc3)c3ccc4oc5ccccc5c4c3)c3ccccc23)cc1.
What is the InChIKey of N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine?
The InChIKey is QDIQPNHDAPQDJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N2O/c1-2-14-37(15-3-1)44-31-32-54(46-19-7-6-18-45(44)46)57(41-30-33-56-51(35-41)49-22-10-13-25-55(49)59-56)40-28-26-38(27-29-40)50-36-42(34-39-16-4-5-17-43(39)50)58-52-23-11-8-20-47(52)48-21-9-12-24-53(48)58/h1-36H.
What are the key properties of N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine?
N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine has a molecular weight of 752.92 g/mol, XLogP of 15.79, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylnaphthalen-1-yl)dibenzofuran-2-amine is sourced from PubChem (CID 168809159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).