N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline

C56H38N2 — CID 167236432

IUPACN-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3cc(-c4ccc5ccccc5c4)ccc3-c3ccc4ccccc4c3)c3ccccc3-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C56H38N2/c1-2-14-39(15-3-1)42-30-33-48(34-31-42)57(54-24-12-13-25-55(54)58-52-22-10-8-20-50(52)51-21-9-11-23-53(51)58)56-38-46(45-28-26-40-16-4-6-18-43(40)36-45)32-35-49(56)47-29-27-41-17-5-7-19-44(41)37-47/h1-38H
InChIKeyQDILJBPLUOQOFO-UHFFFAOYSA-N
MW738.93 g/mol
LogP15.56
Rot. Bonds7

About N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline

N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline (PubChem CID 167236432) has the molecular formula C56H38N2 and a molecular weight of 738.93 g/mol. Its IUPAC name is N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline
PubChem CID167236432
Molecular FormulaC56H38N2
Molecular Weight738.93 g/mol
Exact Mass738.30
IUPAC NameN-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3cc(-c4ccc5ccccc5c4)ccc3-c3ccc4ccccc4c3)c3ccccc3-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C56H38N2/c1-2-14-39(15-3-1)42-30-33-48(34-31-42)57(54-24-12-13-25-55(54)58-52-22-10-8-20-50(52)51-21-9-11-23-53(51)58)56-38-46(45-28-26-40-16-4-6-18-43(40)36-45)32-35-49(56)47-29-27-41-17-5-7-19-44(41)37-47/h1-38H
InChIKeyQDILJBPLUOQOFO-UHFFFAOYSA-N
XLogP15.56
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500738.93
LogP ≤ 515.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-carbazol-9-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-phenylaniline
CID 166566092
N-[4-(2-carbazol-9-ylphenyl)phenyl]-5-naphthalen-2-yl-2-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 167235738
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-2-phenylaniline
CID 167322506
N-[4-(3-carbazol-9-ylphenyl)phenyl]-2,5-dinaphthalen-2-yl-N-(2-phenylphenyl)aniline
CID 167234428
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-[4-(2-naphthalen-2-ylphenyl)phenyl]-2-phenylaniline
CID 167322263
4-(2-carbazol-9-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-3-phenyl-N-(2-phenylphenyl)aniline
CID 174309899
N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-phenylaniline
CID 167236410
N-(2,5-dinaphthalen-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 167235752
2-carbazol-9-yl-N-(4-naphthalen-2-ylphenyl)-N-[3-(9-phenylcarbazol-1-yl)phenyl]aniline
CID 164790690
4-[4-(2-carbazol-9-ylphenyl)phenyl]-N-[4-(3,5-diphenylphenyl)phenyl]-N-(4-naphthalen-2-ylphenyl)aniline
CID 167322678
N-(3-carbazol-9-ylphenyl)-5-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)-2-phenylaniline
CID 167234431
N-(3-carbazol-9-ylphenyl)-5-naphthalen-2-yl-2-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167235229

Frequently Asked Questions

What is the IUPAC name of N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline?
The IUPAC name of N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline (CID 167236432) is N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline?
The canonical SMILES for N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline is c1ccc(-c2ccc(N(c3cc(-c4ccc5ccccc5c4)ccc3-c3ccc4ccccc4c3)c3ccccc3-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline?
The InChIKey is QDILJBPLUOQOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H38N2/c1-2-14-39(15-3-1)42-30-33-48(34-31-42)57(54-24-12-13-25-55(54)58-52-22-10-8-20-50(52)51-21-9-11-23-53(51)58)56-38-46(45-28-26-40-16-4-6-18-43(40)36-45)32-35-49(56)47-29-27-41-17-5-7-19-44(41)37-47/h1-38H.
What are the key properties of N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline?
N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline has a molecular weight of 738.93 g/mol, XLogP of 15.56, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 167236432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).