N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine

C56H38N2 — CID 174258250

IUPACN-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccc5cc(-c6ccc7ccccc7c6)ccc5c4)c3)c3cccc4c3c3ccccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C56H38N2/c1-3-13-39(14-4-1)41-31-33-50(34-32-41)57(54-23-12-24-55-56(54)52-21-9-10-22-53(52)58(55)49-18-5-2-6-19-49)51-20-11-17-43(38-51)44-27-28-48-37-47(30-29-46(48)36-44)45-26-25-40-15-7-8-16-42(40)35-45/h1-38H
InChIKeyQLOTZNYCFHVNOP-UHFFFAOYSA-N
MW738.93 g/mol
LogP15.56
Rot. Bonds7

About N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine

N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine (PubChem CID 174258250) has the molecular formula C56H38N2 and a molecular weight of 738.93 g/mol. Its IUPAC name is N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine.

Molecular Properties

Compound NameN-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine
PubChem CID174258250
Molecular FormulaC56H38N2
Molecular Weight738.93 g/mol
Exact Mass738.30
IUPAC NameN-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccc5cc(-c6ccc7ccccc7c6)ccc5c4)c3)c3cccc4c3c3ccccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C56H38N2/c1-3-13-39(14-4-1)41-31-33-50(34-32-41)57(54-23-12-24-55-56(54)52-21-9-10-22-53(52)58(55)49-18-5-2-6-19-49)51-20-11-17-43(38-51)44-27-28-48-37-47(30-29-46(48)36-44)45-26-25-40-15-7-8-16-42(40)35-45/h1-38H
InChIKeyQLOTZNYCFHVNOP-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,9-diphenyl-N-[6-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]carbazol-4-amine
CID 174257716
N-naphthalen-1-yl-9-(4-naphthalen-2-ylphenyl)-N-phenylcarbazol-2-amine;N-phenyl-N,9-bis(4-phenylphenyl)carbazol-4-amine
CID 160619067
5-naphthalen-2-yl-3-N-(9-phenylcarbazol-4-yl)-1-N,1-N,3-N-tris(4-phenylphenyl)benzene-1,3-diamine;5-naphthalen-2-yl-3-N-(2-phenylphenyl)-1-N,1-N,3-N-tris(4-phenylphenyl)benzene-1,3-diamine;5-naphthalen-2-yl-1-N,1-N,3-N-tris(4-phenylphenyl)-3-N-[4-(3-phenylphenyl)phenyl]benzene-1,3-diamine
CID 163659291
N-(4-naphthalen-2-ylphenyl)-3-(9-phenylcarbazol-4-yl)-N-(4-phenylphenyl)aniline
CID 167195790
N-(4-chrysen-6-ylphenyl)-9-phenyl-N-(3-phenylphenyl)carbazol-4-amine
CID 170138400
N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine
CID 165006232
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 174258329
9-phenyl-N-[7-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]-N-(2-phenylphenyl)carbazol-4-amine
CID 174257736
N-(4-carbazol-9-ylphenyl)-3-naphthalen-2-yl-N-phenylaniline
CID 135164563
N-(7-naphthalen-2-ylnaphthalen-1-yl)-N,9-diphenylcarbazol-3-amine
CID 176587933
N-(3-naphthalen-2-ylphenyl)-N-[3-(9-phenylcarbazol-4-yl)phenyl]-2-[2-(2-phenylphenyl)phenyl]aniline
CID 172501542
N-[4-(7-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(3-phenylphenyl)carbazol-2-amine
CID 174258406

Frequently Asked Questions

What is the IUPAC name of N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine?
The IUPAC name of N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine (CID 174258250) is N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine.
What is the SMILES notation for N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine?
The canonical SMILES for N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine is c1ccc(-c2ccc(N(c3cccc(-c4ccc5cc(-c6ccc7ccccc7c6)ccc5c4)c3)c3cccc4c3c3ccccc3n4-c3ccccc3)cc2)cc1.
What is the InChIKey of N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine?
The InChIKey is QLOTZNYCFHVNOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H38N2/c1-3-13-39(14-4-1)41-31-33-50(34-32-41)57(54-23-12-24-55-56(54)52-21-9-10-22-53(52)58(55)49-18-5-2-6-19-49)51-20-11-17-43(38-51)44-27-28-48-37-47(30-29-46(48)36-44)45-26-25-40-15-7-8-16-42(40)35-45/h1-38H.
What are the key properties of N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine?
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-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-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine is sourced from PubChem (CID 174258250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).