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

C60H40N2O — CID 139544521

IUPAC2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline
SMILESc1ccc(-c2cccc(N(c3ccc(-c4ccccc4-c4cccc5c4oc4ccccc45)cc3)c3ccccc3-c3ccccc3-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/C60H40N2O/c1-2-18-41(19-3-1)43-20-16-21-45(40-43)61(44-38-36-42(37-39-44)46-22-4-5-23-47(46)53-29-17-30-54-52-28-10-15-35-59(52)63-60(53)54)55-31-11-6-24-48(55)49-25-7-12-32-56(49)62-57-33-13-8-26-50(57)51-27-9-14-34-58(51)62/h1-40H
InChIKeyJCIDHPMCOYGSRU-UHFFFAOYSA-N
MW804.99 g/mol
LogP16.82
Rot. Bonds8

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

2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline (PubChem CID 139544521) has the molecular formula C60H40N2O and a molecular weight of 804.99 g/mol. Its IUPAC name is 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline.

Molecular Properties

Compound Name2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline
PubChem CID139544521
Molecular FormulaC60H40N2O
Molecular Weight804.99 g/mol
Exact Mass804.31
IUPAC Name2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline
SMILESc1ccc(-c2cccc(N(c3ccc(-c4ccccc4-c4cccc5c4oc4ccccc45)cc3)c3ccccc3-c3ccccc3-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/C60H40N2O/c1-2-18-41(19-3-1)43-20-16-21-45(40-43)61(44-38-36-42(37-39-44)46-22-4-5-23-47(46)53-29-17-30-54-52-28-10-15-35-59(52)63-60(53)54)55-31-11-6-24-48(55)49-25-7-12-32-56(49)62-57-33-13-8-26-50(57)51-27-9-14-34-58(51)62/h1-40H
InChIKeyJCIDHPMCOYGSRU-UHFFFAOYSA-N
XLogP16.82
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500804.99
LogP ≤ 516.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(4-phenylphenyl)aniline
CID 139544729
3-[2-(2-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline;N-[3-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(3-phenylphenyl)aniline;N-[3-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(4-phenylphenyl)aniline;N-[3-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-3-(3-phenylphenyl)aniline
CID 160833679
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(3-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline
CID 139544519
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(3-dibenzofuran-4-ylphenyl)-2-phenylaniline
CID 139544776
N-[2-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-2-phenylaniline
CID 139544518
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-3-dibenzofuran-4-yl-N-phenylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(3-dibenzofuran-4-ylphenyl)naphthalen-1-amine;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-3-(4-phenylphenyl)aniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)aniline
CID 159361704
3-(2-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline;N-[3-(2-carbazol-9-ylphenyl)phenyl]-N-(3-dibenzofuran-4-ylphenyl)-2-(3-phenylphenyl)aniline;N-[3-(2-carbazol-9-ylphenyl)phenyl]-N-(3-dibenzofuran-4-ylphenyl)-3-(3-phenylphenyl)aniline
CID 157078470
N-[4-(2-carbazol-9-ylphenyl)phenyl]-2-(6-phenyldibenzofuran-4-yl)-N-(3-phenylphenyl)aniline
CID 139544676
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(2-dibenzofuran-4-ylphenyl)-2-(4-phenylphenyl)aniline
CID 139544595
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(2-dibenzofuran-4-ylphenyl)phenanthren-3-amine
CID 139545077
N-[3-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)naphthalen-1-amine
CID 139544547
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-4-phenanthren-2-ylaniline;N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-(2-phenylphenyl)aniline
CID 159572634

Frequently Asked Questions

What is the IUPAC name of 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline?
The IUPAC name of 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline (CID 139544521) is 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline.
What is the SMILES notation for 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline?
The canonical SMILES for 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline is c1ccc(-c2cccc(N(c3ccc(-c4ccccc4-c4cccc5c4oc4ccccc45)cc3)c3ccccc3-c3ccccc3-n3c4ccccc4c4ccccc43)c2)cc1.
What is the InChIKey of 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline?
The InChIKey is JCIDHPMCOYGSRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2O/c1-2-18-41(19-3-1)43-20-16-21-45(40-43)61(44-38-36-42(37-39-44)46-22-4-5-23-47(46)53-29-17-30-54-52-28-10-15-35-59(52)63-60(53)54)55-31-11-6-24-48(55)49-25-7-12-32-56(49)62-57-33-13-8-26-50(57)51-27-9-14-34-58(51)62/h1-40H.
What are the key properties of 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline?
2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline has a molecular weight of 804.99 g/mol, XLogP of 16.82, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-carbazol-9-ylphenyl)-N-[4-(2-dibenzofuran-4-ylphenyl)phenyl]-N-(3-phenylphenyl)aniline is sourced from PubChem (CID 139544521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).