N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine

C66H43N3O — CID 142416213

IUPACN-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine
SMILESc1ccc(-n2c3ccccc3c3ccccc32)c(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5-n5c6ccccc6c6ccccc65)cc4)c4ccc5c(c4)oc4ccccc45)cc3)cc2)c1
InChIInChI=1S/C66H43N3O/c1-8-22-59(68-61-24-10-3-17-53(61)54-18-4-11-25-62(54)68)51(15-1)46-31-29-44(30-32-46)45-33-37-48(38-34-45)67(50-41-42-58-57-21-7-14-28-65(57)70-66(58)43-50)49-39-35-47(36-40-49)52-16-2-9-23-60(52)69-63-26-12-5-19-55(63)56-20-6-13-27-64(56)69/h1-43H
InChIKeyCWQNDEVTEBGGJX-UHFFFAOYSA-N
MW894.09 g/mol
LogP18.25
Rot. Bonds8

About N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine

N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine (PubChem CID 142416213) has the molecular formula C66H43N3O and a molecular weight of 894.09 g/mol. Its IUPAC name is N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine.

Molecular Properties

Compound NameN-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine
PubChem CID142416213
Molecular FormulaC66H43N3O
Molecular Weight894.09 g/mol
Exact Mass893.34
IUPAC NameN-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine
SMILESc1ccc(-n2c3ccccc3c3ccccc32)c(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5-n5c6ccccc6c6ccccc65)cc4)c4ccc5c(c4)oc4ccccc45)cc3)cc2)c1
InChIInChI=1S/C66H43N3O/c1-8-22-59(68-61-24-10-3-17-53(61)54-18-4-11-25-62(54)68)51(15-1)46-31-29-44(30-32-46)45-33-37-48(38-34-45)67(50-41-42-58-57-21-7-14-28-65(57)70-66(58)43-50)49-39-35-47(36-40-49)52-16-2-9-23-60(52)69-63-26-12-5-19-55(63)56-20-6-13-27-64(56)69/h1-43H
InChIKeyCWQNDEVTEBGGJX-UHFFFAOYSA-N
XLogP18.25
TPSA26.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500894.09
LogP ≤ 518.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(3-dibenzofuran-3-ylphenyl)-3-phenylaniline
CID 153314590
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine
CID 153314743
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-3-ylphenyl)naphthalen-2-amine
CID 153190885
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzofuran-3-amine
CID 166565654
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]-3-(3-phenylphenyl)aniline
CID 153314841
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine
CID 167322537
N-[4-[3-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-phenanthren-2-ylphenyl)dibenzofuran-3-amine
CID 167322658
9-carbazol-9-yl-N,N-bis(4-dibenzofuran-4-ylphenyl)dibenzofuran-3-amine
CID 165374573
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-3-ylphenyl)-2-(4-phenylphenyl)aniline
CID 153314946
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine
CID 167322367
N-(4-carbazol-9-ylphenyl)-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 131972152
N-[4-(2-carbazol-9-ylphenyl)phenyl]-3-dibenzofuran-3-yl-N-(4-phenanthren-9-ylphenyl)aniline
CID 153314732

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine?
The IUPAC name of N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine (CID 142416213) is N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine.
What is the SMILES notation for N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine?
The canonical SMILES for N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine is c1ccc(-n2c3ccccc3c3ccccc32)c(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5-n5c6ccccc6c6ccccc65)cc4)c4ccc5c(c4)oc4ccccc45)cc3)cc2)c1.
What is the InChIKey of N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine?
The InChIKey is CWQNDEVTEBGGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H43N3O/c1-8-22-59(68-61-24-10-3-17-53(61)54-18-4-11-25-62(54)68)51(15-1)46-31-29-44(30-32-46)45-33-37-48(38-34-45)67(50-41-42-58-57-21-7-14-28-65(57)70-66(58)43-50)49-39-35-47(36-40-49)52-16-2-9-23-60(52)69-63-26-12-5-19-55(63)56-20-6-13-27-64(56)69/h1-43H.
What are the key properties of N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine?
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine has a molecular weight of 894.09 g/mol, XLogP of 18.25, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine is sourced from PubChem (CID 142416213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).