N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine

C58H40N2 — CID 174310766

IUPACN-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine
SMILESc1ccc(-c2cc(N(c3ccccc3)c3ccc(-c4ccccc4-c4ccccc4)c4ccccc34)ccc2-c2ccccc2-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C58H40N2/c1-4-20-41(21-5-1)45-26-10-11-27-46(45)48-38-39-58(50-29-13-12-28-47(48)50)59(43-24-8-3-9-25-43)44-36-37-49(54(40-44)42-22-6-2-7-23-42)51-30-14-17-33-55(51)60-56-34-18-15-31-52(56)53-32-16-19-35-57(53)60/h1-40H
InChIKeyPQFAGXBPNWOOKL-UHFFFAOYSA-N
MW764.97 g/mol
LogP16.07
Rot. Bonds8

About N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine

N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine (PubChem CID 174310766) has the molecular formula C58H40N2 and a molecular weight of 764.97 g/mol. Its IUPAC name is N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine.

Molecular Properties

Compound NameN-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine
PubChem CID174310766
Molecular FormulaC58H40N2
Molecular Weight764.97 g/mol
Exact Mass764.32
IUPAC NameN-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine
SMILESc1ccc(-c2cc(N(c3ccccc3)c3ccc(-c4ccccc4-c4ccccc4)c4ccccc34)ccc2-c2ccccc2-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C58H40N2/c1-4-20-41(21-5-1)45-26-10-11-27-46(45)48-38-39-58(50-29-13-12-28-47(48)50)59(43-24-8-3-9-25-43)44-36-37-49(54(40-44)42-22-6-2-7-23-42)51-30-14-17-33-55(51)60-56-34-18-15-31-52(56)53-32-16-19-35-57(53)60/h1-40H
InChIKeyPQFAGXBPNWOOKL-UHFFFAOYSA-N
XLogP16.07
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500764.97
LogP ≤ 516.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-carbazol-9-ylphenyl)-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 167227694
N-[4-(2-carbazol-9-ylphenyl)naphthalen-1-yl]-4-phenyl-N-(4-phenylphenyl)naphthalen-1-amine
CID 167227701
N-[4-[2-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,4-diphenylaniline
CID 167322731
N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]naphthalen-1-amine
CID 174309808
4-(2-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)naphthalen-1-amine
CID 167227719
N-[4-(2-carbazol-9-ylphenyl)phenyl]-3-[5-(2-phenylphenyl)naphthalen-1-yl]-N-[4-[5-(2-phenylphenyl)naphthalen-1-yl]phenyl]aniline
CID 170664617
N-[4-(2-carbazol-9-ylphenyl)naphthalen-1-yl]-N-phenyldibenzothiophen-2-amine
CID 167227767
4-(2-carbazol-9-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-3-phenyl-N-(2-phenylphenyl)aniline
CID 174309899
4-(2-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-3-phenyl-N-(4-phenylphenyl)aniline
CID 167528489
4-(2-carbazol-9-ylphenyl)-N-[3-(4-naphthalen-1-ylphenyl)phenyl]-N,3-diphenylaniline
CID 174310000
N-[4-(2-carbazol-9-ylphenyl)phenyl]-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-2-amine
CID 172503107
N-[4-(3-carbazol-9-yl-2-phenylphenyl)phenyl]-3,4-diphenyl-N-(2-phenylphenyl)aniline
CID 170271781

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine?
The IUPAC name of N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine (CID 174310766) is N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine.
What is the SMILES notation for N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine?
The canonical SMILES for N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine is c1ccc(-c2cc(N(c3ccccc3)c3ccc(-c4ccccc4-c4ccccc4)c4ccccc34)ccc2-c2ccccc2-n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine?
The InChIKey is PQFAGXBPNWOOKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H40N2/c1-4-20-41(21-5-1)45-26-10-11-27-46(45)48-38-39-58(50-29-13-12-28-47(48)50)59(43-24-8-3-9-25-43)44-36-37-49(54(40-44)42-22-6-2-7-23-42)51-30-14-17-33-55(51)60-56-34-18-15-31-52(56)53-32-16-19-35-57(53)60/h1-40H.
What are the key properties of N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine?
N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine has a molecular weight of 764.97 g/mol, XLogP of 16.07, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-carbazol-9-ylphenyl)-3-phenylphenyl]-N-phenyl-4-(2-phenylphenyl)naphthalen-1-amine is sourced from PubChem (CID 174310766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).