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

C56H38N2 — CID 126627950

IUPACN-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5ccccc5-c5cccc(N(c6cccc7ccccc67)c6cccc7ccccc67)c5)cc43)cc2)cc1
InChIInChI=1S/C56H38N2/c1-2-15-39(16-3-1)40-31-34-45(35-32-40)57-55-28-11-10-27-51(55)52-36-33-44(38-56(52)57)48-24-9-8-23-47(48)43-21-12-22-46(37-43)58(53-29-13-19-41-17-4-6-25-49(41)53)54-30-14-20-42-18-5-7-26-50(42)54/h1-38H
InChIKeyTZWFEFVHXOCMBB-UHFFFAOYSA-N
MW738.93 g/mol
LogP15.56
Rot. Bonds7

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

N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine (PubChem CID 126627950) has the molecular formula C56H38N2 and a molecular weight of 738.93 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine
PubChem CID126627950
Molecular FormulaC56H38N2
Molecular Weight738.93 g/mol
Exact Mass738.30
IUPAC NameN-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5ccccc5-c5cccc(N(c6cccc7ccccc67)c6cccc7ccccc67)c5)cc43)cc2)cc1
InChIInChI=1S/C56H38N2/c1-2-15-39(16-3-1)40-31-34-45(35-32-40)57-55-28-11-10-27-51(55)52-36-33-44(38-56(52)57)48-24-9-8-23-47(48)43-21-12-22-46(37-43)58(53-29-13-19-41-17-4-6-25-49(41)53)54-30-14-20-42-18-5-7-26-50(42)54/h1-38H
InChIKeyTZWFEFVHXOCMBB-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

N-(4-phenylphenyl)-N-[4-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine
CID 126627984
N-naphthalen-1-yl-N-[3-[2-[9-[4-(3-phenylphenyl)phenyl]carbazol-2-yl]phenyl]phenyl]naphthalen-2-amine
CID 118337362
N-(3-naphthalen-1-ylphenyl)-3-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-2-(2-phenylphenyl)aniline
CID 168789220
N-(4-carbazol-9-ylphenyl)-3-naphthalen-1-yl-N-[4-[2-[2-(2-phenylphenyl)phenyl]phenyl]phenyl]aniline
CID 172501687
N-[4-[4-(2-carbazol-9-ylcarbazol-9-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 118152627
N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]naphthalen-1-amine
CID 168790590
3-phenyl-N-[3-(9-phenylcarbazol-2-yl)phenyl]-2-(2-phenylphenyl)-N-[2-(4-phenylphenyl)phenyl]aniline
CID 168790192
4-(4-carbazol-9-ylphenyl)-N,N-diphenylaniline;4-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-phenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N,4-diphenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-2-amine
CID 159528912
N-(4-carbazol-9-ylphenyl)-N-(3-naphthalen-1-ylphenyl)-3-phenyl-2-(2-phenylphenyl)aniline
CID 168790997
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[3-(9-phenylcarbazol-4-yl)phenyl]naphthalen-1-amine
CID 167195242
3-[2-[9-(3,5-diphenylphenyl)carbazol-2-yl]phenyl]-N,N-diphenylaniline
CID 118337352
N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-(3-phenylphenyl)-2-[2-(2-phenylphenyl)phenyl]aniline
CID 172501079

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine?
The IUPAC name of N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine (CID 126627950) is N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine.
What is the SMILES notation for N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine?
The canonical SMILES for N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine is c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5ccccc5-c5cccc(N(c6cccc7ccccc67)c6cccc7ccccc67)c5)cc43)cc2)cc1.
What is the InChIKey of N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine?
The InChIKey is TZWFEFVHXOCMBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H38N2/c1-2-15-39(16-3-1)40-31-34-45(35-32-40)57-55-28-11-10-27-51(55)52-36-33-44(38-56(52)57)48-24-9-8-23-47(48)43-21-12-22-46(37-43)58(53-29-13-19-41-17-4-6-25-49(41)53)54-30-14-20-42-18-5-7-26-50(42)54/h1-38H.
What are the key properties of N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine?
N-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine 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-naphthalen-1-yl-N-[3-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine is sourced from PubChem (CID 126627950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).