N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine

C58H38N2O — CID 177286461

IUPACN-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine
SMILESc1ccc(-c2cc(-c3ccccc3)c3c(c2)c2cc(N(c4ccc(-c5ccc6ccccc6c5)cc4)c4ccc5oc6ccccc6c5c4)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C58H38N2O/c1-4-14-39(15-5-1)45-35-51(42-17-6-2-7-18-42)58-54(36-45)52-37-48(30-32-55(52)60(58)46-20-8-3-9-21-46)59(49-31-33-57-53(38-49)50-22-12-13-23-56(50)61-57)47-28-26-41(27-29-47)44-25-24-40-16-10-11-19-43(40)34-44/h1-38H
InChIKeyMGJVHEKYQKPUTR-UHFFFAOYSA-N
MW778.96 g/mol
LogP16.31
Rot. Bonds7

About N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine

N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine (PubChem CID 177286461) has the molecular formula C58H38N2O and a molecular weight of 778.96 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine
PubChem CID177286461
Molecular FormulaC58H38N2O
Molecular Weight778.96 g/mol
Exact Mass778.30
IUPAC NameN-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine
SMILESc1ccc(-c2cc(-c3ccccc3)c3c(c2)c2cc(N(c4ccc(-c5ccc6ccccc6c5)cc4)c4ccc5oc6ccccc6c5c4)ccc2n3-c2ccccc2)cc1
InChIInChI=1S/C58H38N2O/c1-4-14-39(15-5-1)45-35-51(42-17-6-2-7-18-42)58-54(36-45)52-37-48(30-32-55(52)60(58)46-20-8-3-9-21-46)59(49-31-33-57-53(38-49)50-22-12-13-23-56(50)61-57)47-28-26-41(27-29-47)44-25-24-40-16-10-11-19-43(40)34-44/h1-38H
InChIKeyMGJVHEKYQKPUTR-UHFFFAOYSA-N
XLogP16.31
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500778.96
LogP ≤ 516.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-naphthalen-2-ylphenyl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-2-amine
CID 58510646
N-[3-[4-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121443601
3-[4-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N,N-diphenylaniline;bis(N-[3-[4-[2-dibenzofuran-2-yl-4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine)
CID 160545889
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-2-ylphenyl)-6,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]-4-(4-phenylphenyl)aniline;9-phenyl-N-[4-(8-phenyldibenzofuran-2-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
CID 158901637
N-(4-dibenzofuran-2-ylphenyl)-N-phenanthren-3-yl-9-phenylcarbazol-3-amine
CID 168809759
N-[4-(6-dibenzofuran-2-yl-9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 90194656
N-[4-[3-dibenzofuran-2-yl-5-(9-phenylcarbazol-3-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 121443574
N-[4-[4-[3,6-bis(4-dibenzofuran-2-ylphenyl)carbazol-9-yl]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 118402366
3-N-dibenzofuran-2-yl-1-N,3-N-diphenyl-5-(9-phenylcarbazol-3-yl)-1-N-(4-phenylphenyl)benzene-1,3-diamine
CID 176781523
N-dibenzofuran-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]dibenzofuran-2-amine;4-phenyl-N,N-bis[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-phenyl-4-(9-phenylcarbazol-3-yl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 158933576
N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 118462582
4-(3-carbazol-9-ylphenyl)-N-(4-dibenzofuran-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 146578288

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine?
The IUPAC name of N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine (CID 177286461) is N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine.
What is the SMILES notation for N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine?
The canonical SMILES for N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine is c1ccc(-c2cc(-c3ccccc3)c3c(c2)c2cc(N(c4ccc(-c5ccc6ccccc6c5)cc4)c4ccc5oc6ccccc6c5c4)ccc2n3-c2ccccc2)cc1.
What is the InChIKey of N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine?
The InChIKey is MGJVHEKYQKPUTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H38N2O/c1-4-14-39(15-5-1)45-35-51(42-17-6-2-7-18-42)58-54(36-45)52-37-48(30-32-55(52)60(58)46-20-8-3-9-21-46)59(49-31-33-57-53(38-49)50-22-12-13-23-56(50)61-57)47-28-26-41(27-29-47)44-25-24-40-16-10-11-19-43(40)34-44/h1-38H.
What are the key properties of N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine?
N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine has a molecular weight of 778.96 g/mol, XLogP of 16.31, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-N-(4-naphthalen-2-ylphenyl)-6,8,9-triphenylcarbazol-3-amine is sourced from PubChem (CID 177286461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).