N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline

C60H40N2 — CID 167233971

IUPACN-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline
SMILESc1ccc2cc(-c3ccc(-c4ccc5ccccc5c4)c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3)ccc2c1
InChIInChI=1S/C60H40N2/c1-3-15-45-38-47(26-24-41(45)12-1)48-30-37-55(49-27-25-42-13-2-4-16-46(42)39-49)60(40-48)61(50-31-28-44(29-32-50)54-21-11-17-43-14-5-6-18-53(43)54)51-33-35-52(36-34-51)62-58-22-9-7-19-56(58)57-20-8-10-23-59(57)62/h1-40H
InChIKeyWYCAONVITAVUNQ-UHFFFAOYSA-N
MW788.99 g/mol
LogP16.71
Rot. Bonds7

About N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline

N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline (PubChem CID 167233971) has the molecular formula C60H40N2 and a molecular weight of 788.99 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline
PubChem CID167233971
Molecular FormulaC60H40N2
Molecular Weight788.99 g/mol
Exact Mass788.32
IUPAC NameN-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline
SMILESc1ccc2cc(-c3ccc(-c4ccc5ccccc5c4)c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3)ccc2c1
InChIInChI=1S/C60H40N2/c1-3-15-45-38-47(26-24-41(45)12-1)48-30-37-55(49-27-25-42-13-2-4-16-46(42)39-49)60(40-48)61(50-31-28-44(29-32-50)54-21-11-17-43-14-5-6-18-53(43)54)51-33-35-52(36-34-51)62-58-22-9-7-19-56(58)57-20-8-10-23-59(57)62/h1-40H
InChIKeyWYCAONVITAVUNQ-UHFFFAOYSA-N
XLogP16.71
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500788.99
LogP ≤ 516.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-phenylaniline
CID 167236410
N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-naphthalen-2-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline
CID 157492697
N-[4-(3-carbazol-9-ylphenyl)phenyl]-5-naphthalen-1-yl-2-phenyl-N-(4-phenylphenyl)aniline
CID 167234123
N-(4-carbazol-9-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-N-[4-(6-phenylnaphthalen-2-yl)phenyl]aniline
CID 146580365
N-[4-(3-carbazol-9-ylphenyl)phenyl]-2,5-dinaphthalen-2-yl-N-(2-phenylphenyl)aniline
CID 167234428
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
N-[4-(2-carbazol-9-ylphenyl)phenyl]-5-naphthalen-2-yl-2-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 167235738
N,N-bis(4-naphthalen-1-ylphenyl)-2-(9-phenylcarbazol-3-yl)aniline;N,N-bis(4-naphthalen-1-ylphenyl)-6-(9-phenylcarbazol-3-yl)naphthalen-2-amine;N,N-bis(4-naphthalen-1-ylphenyl)-4-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N,N-bis(4-naphthalen-1-ylphenyl)-4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]aniline
CID 157104879
5-naphthalen-2-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 167235721
N-[4-(3-carbazol-9-ylphenyl)phenyl]-5-phenanthren-1-yl-2-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 167235316
4-(3-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 146578387

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline (CID 167233971) is N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline is c1ccc2cc(-c3ccc(-c4ccc5ccccc5c4)c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3)ccc2c1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline?
The InChIKey is WYCAONVITAVUNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2/c1-3-15-45-38-47(26-24-41(45)12-1)48-30-37-55(49-27-25-42-13-2-4-16-46(42)39-49)60(40-48)61(50-31-28-44(29-32-50)54-21-11-17-43-14-5-6-18-53(43)54)51-33-35-52(36-34-51)62-58-22-9-7-19-56(58)57-20-8-10-23-59(57)62/h1-40H.
What are the key properties of N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline?
N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline has a molecular weight of 788.99 g/mol, XLogP of 16.71, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-2,5-dinaphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline is sourced from PubChem (CID 167233971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).