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

C54H34N2O2 — CID 167322537

IUPACN-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine
SMILESc1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)c(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4oc5ccccc5c4c3)cc2)c1
InChIInChI=1S/C54H34N2O2/c1-2-14-40(41-15-3-8-20-48(41)56-49-21-9-4-16-42(49)43-17-5-10-22-50(43)56)39(13-1)35-25-27-36(28-26-35)55(37-29-31-53-46(33-37)44-18-6-11-23-51(44)57-53)38-30-32-54-47(34-38)45-19-7-12-24-52(45)58-54/h1-34H
InChIKeyMMQCLYXETGYZJN-UHFFFAOYSA-N
MW742.88 g/mol
LogP15.39
Rot. Bonds6

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

N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine (PubChem CID 167322537) has the molecular formula C54H34N2O2 and a molecular weight of 742.88 g/mol. Its IUPAC name is N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine.

Molecular Properties

Compound NameN-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine
PubChem CID167322537
Molecular FormulaC54H34N2O2
Molecular Weight742.88 g/mol
Exact Mass742.26
IUPAC NameN-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine
SMILESc1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)c(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4oc5ccccc5c4c3)cc2)c1
InChIInChI=1S/C54H34N2O2/c1-2-14-40(41-15-3-8-20-48(41)56-49-21-9-4-16-42(49)43-17-5-10-22-50(43)56)39(13-1)35-25-27-36(28-26-35)55(37-29-31-53-46(33-37)44-18-6-11-23-51(44)57-53)38-30-32-54-47(34-38)45-19-7-12-24-52(45)58-54/h1-34H
InChIKeyMMQCLYXETGYZJN-UHFFFAOYSA-N
XLogP15.39
TPSA34.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500742.88
LogP ≤ 515.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(2-dibenzofuran-3-ylphenyl)phenyl]triphenylen-2-amine
CID 153314743
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]triphenylen-2-amine
CID 139544867
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-naphthalen-2-ylphenyl)dibenzofuran-2-amine
CID 167322367
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]dibenzofuran-3-amine
CID 142416213
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 168788525
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzothiophen-4-yldibenzofuran-2-amine
CID 167322717
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)phenanthren-3-amine
CID 139544784
N-[4-(9-phenylcarbazol-1-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]dibenzofuran-2-amine
CID 164790790
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]-3-(3-phenylphenyl)aniline
CID 153314841
N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)dibenzofuran-2-amine
CID 58510687
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-3-ylphenyl)naphthalen-2-amine
CID 153190885

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine?
The IUPAC name of N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine (CID 167322537) is N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine.
What is the SMILES notation for N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine?
The canonical SMILES for N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine is c1ccc(-c2ccccc2-n2c3ccccc3c3ccccc32)c(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4oc5ccccc5c4c3)cc2)c1.
What is the InChIKey of N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine?
The InChIKey is MMQCLYXETGYZJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N2O2/c1-2-14-40(41-15-3-8-20-48(41)56-49-21-9-4-16-42(49)43-17-5-10-22-50(43)56)39(13-1)35-25-27-36(28-26-35)55(37-29-31-53-46(33-37)44-18-6-11-23-51(44)57-53)38-30-32-54-47(34-38)45-19-7-12-24-52(45)58-54/h1-34H.
What are the key properties of N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine?
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine has a molecular weight of 742.88 g/mol, XLogP of 15.39, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-dibenzofuran-2-yldibenzofuran-2-amine is sourced from PubChem (CID 167322537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).