N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine

C54H36N2O — CID 169010211

IUPACN-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2cccc(-c3cccc4c3c3ccc(N(c5cccc(-c6ccccc6)c5)c5cccc6oc7ccccc7c56)cc3n4-c3ccccc3)c2)cc1
InChIInChI=1S/C54H36N2O/c1-4-16-37(17-5-1)39-20-12-22-41(34-39)45-27-14-28-48-53(45)46-33-32-44(36-50(46)56(48)42-23-8-3-9-24-42)55(43-25-13-21-40(35-43)38-18-6-2-7-19-38)49-29-15-31-52-54(49)47-26-10-11-30-51(47)57-52/h1-36H
InChIKeyUPHBBZMLIAOHQS-UHFFFAOYSA-N
MW728.90 g/mol
LogP15.15
Rot. Bonds7

About N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine

N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine (PubChem CID 169010211) has the molecular formula C54H36N2O and a molecular weight of 728.90 g/mol. Its IUPAC name is N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine.

Molecular Properties

Compound NameN-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine
PubChem CID169010211
Molecular FormulaC54H36N2O
Molecular Weight728.90 g/mol
Exact Mass728.28
IUPAC NameN-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2cccc(-c3cccc4c3c3ccc(N(c5cccc(-c6ccccc6)c5)c5cccc6oc7ccccc7c56)cc3n4-c3ccccc3)c2)cc1
InChIInChI=1S/C54H36N2O/c1-4-16-37(17-5-1)39-20-12-22-41(34-39)45-27-14-28-48-53(45)46-33-32-44(36-50(46)56(48)42-23-8-3-9-24-42)55(43-25-13-21-40(35-43)38-18-6-2-7-19-38)49-29-15-31-52-54(49)47-26-10-11-30-51(47)57-52/h1-36H
InChIKeyUPHBBZMLIAOHQS-UHFFFAOYSA-N
XLogP15.15
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500728.90
LogP ≤ 515.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-dibenzofuran-1-yl-5,9-diphenyl-N-(2-phenylphenyl)carbazol-2-amine
CID 169009626
N-dibenzofuran-1-yl-9-phenyl-5-(2-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169010129
N-dibenzofuran-1-yl-N,5,9-triphenylcarbazol-3-amine
CID 169009623
N-(4-dibenzofuran-1-ylphenyl)-N,5,9-triphenylcarbazol-2-amine
CID 169010360
5,9-diphenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)carbazol-2-amine
CID 169010333
N-(3-dibenzofuran-3-ylphenyl)-N-[3-(9-phenylcarbazol-4-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)aniline
CID 170298395
N-(3-naphtho[2,1-b][1]benzofuran-1-ylphenyl)-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine
CID 168807443
N-(3-dibenzofuran-2-ylphenyl)-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171738743
5-(9-phenylcarbazol-4-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-11-amine
CID 176795776
N,9-diphenyl-5-(3-phenylphenyl)-N-(4-phenylphenyl)carbazol-2-amine
CID 169009789
N-(3-dibenzofuran-1-yl-2-phenylphenyl)-9-phenyl-N-(3-phenylphenyl)carbazol-4-amine
CID 170666069
N-[4-[3-(4-carbazol-9-ylphenyl)phenyl]phenyl]-N-(3-dibenzofuran-1-ylphenyl)-2-(2-phenylphenyl)aniline
CID 155398519

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine?
The IUPAC name of N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine (CID 169010211) is N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine.
What is the SMILES notation for N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine?
The canonical SMILES for N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine is c1ccc(-c2cccc(-c3cccc4c3c3ccc(N(c5cccc(-c6ccccc6)c5)c5cccc6oc7ccccc7c56)cc3n4-c3ccccc3)c2)cc1.
What is the InChIKey of N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine?
The InChIKey is UPHBBZMLIAOHQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H36N2O/c1-4-16-37(17-5-1)39-20-12-22-41(34-39)45-27-14-28-48-53(45)46-33-32-44(36-50(46)56(48)42-23-8-3-9-24-42)55(43-25-13-21-40(35-43)38-18-6-2-7-19-38)49-29-15-31-52-54(49)47-26-10-11-30-51(47)57-52/h1-36H.
What are the key properties of N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine?
N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine has a molecular weight of 728.90 g/mol, XLogP of 15.15, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-1-yl-9-phenyl-N,5-bis(3-phenylphenyl)carbazol-2-amine is sourced from PubChem (CID 169010211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).