N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine

C74H48N4 — CID 89213110

IUPACN-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc(N(c5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)c6ccccc56)c5ccc(-n6c7ccccc7c7ccccc76)c6ccccc56)cc4)cc32)cc1
InChIInChI=1S/C74H48N4/c1-3-19-52(20-4-1)76-66-31-15-11-29-62(66)64-41-37-50(47-73(64)76)49-35-39-54(40-36-49)75(71-45-46-72(61-26-10-9-25-60(61)71)78-68-33-17-13-27-58(68)59-28-14-18-34-69(59)78)70-44-43-55(56-23-7-8-24-57(56)70)51-38-42-65-63-30-12-16-32-67(63)77(74(65)48-51)53-21-5-2-6-22-53/h1-48H
InChIKeyLFJITZHFWQMXDK-UHFFFAOYSA-N
MW993.23 g/mol
LogP20.09
Rot. Bonds8

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

N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine (PubChem CID 89213110) has the molecular formula C74H48N4 and a molecular weight of 993.23 g/mol. Its IUPAC name is N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine
PubChem CID89213110
Molecular FormulaC74H48N4
Molecular Weight993.23 g/mol
Exact Mass992.39
IUPAC NameN-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc(N(c5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)c6ccccc56)c5ccc(-n6c7ccccc7c7ccccc76)c6ccccc56)cc4)cc32)cc1
InChIInChI=1S/C74H48N4/c1-3-19-52(20-4-1)76-66-31-15-11-29-62(66)64-41-37-50(47-73(64)76)49-35-39-54(40-36-49)75(71-45-46-72(61-26-10-9-25-60(61)71)78-68-33-17-13-27-58(68)59-28-14-18-34-69(59)78)70-44-43-55(56-23-7-8-24-57(56)70)51-38-42-65-63-30-12-16-32-67(63)77(74(65)48-51)53-21-5-2-6-22-53/h1-48H
InChIKeyLFJITZHFWQMXDK-UHFFFAOYSA-N
XLogP20.09
TPSA18.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500993.23
LogP ≤ 520.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]naphthalen-1-amine
CID 89212986
4-(9-phenylcarbazol-3-yl)-N-[4-(9-phenylcarbazol-2-yl)naphthalen-1-yl]-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]naphthalen-1-amine;4-(9-phenylcarbazol-2-yl)-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]naphthalen-1-amine
CID 157357490
4-(9-phenylcarbazol-2-yl)-N,N-bis[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]naphthalen-1-amine;4-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]aniline
CID 158955630
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-[7-[3-[3-[4-[N-(4-carbazol-9-ylphenyl)-4-(9-phenylcarbazol-3-yl)anilino]naphthalen-1-yl]carbazol-9-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine
CID 138506678
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(9-phenylcarbazol-2-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 71038382
N-(9-phenylcarbazol-2-yl)-9-(4-phenylnaphthalen-1-yl)-N-(4-phenylphenyl)carbazol-1-amine
CID 155004375
N-(4-carbazol-9-ylnaphthalen-1-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]dibenzofuran-2-amine
CID 71038542
N-(4-carbazol-9-ylphenyl)-4-(9-phenylcarbazol-3-yl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 71038259
N,N-bis(4-phenylphenyl)-2-[4-phenyl-2-(9-phenylcarbazol-2-yl)phenyl]aniline
CID 118337780
2-[9-(2,5-diphenylphenyl)carbazol-2-yl]-N,N-bis(4-phenylphenyl)aniline
CID 118349607
2-[3-(9-phenylcarbazol-2-yl)phenyl]-N,N-bis(4-phenylphenyl)aniline
CID 118505760
4-phenyl-N-[4-[4-(2-phenylcarbazol-9-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 121312854

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine?
The IUPAC name of N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine (CID 89213110) is N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine.
What is the SMILES notation for N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine?
The canonical SMILES for N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine is c1ccc(-n2c3ccccc3c3ccc(-c4ccc(N(c5ccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)c6ccccc56)c5ccc(-n6c7ccccc7c7ccccc76)c6ccccc56)cc4)cc32)cc1.
What is the InChIKey of N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine?
The InChIKey is LFJITZHFWQMXDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H48N4/c1-3-19-52(20-4-1)76-66-31-15-11-29-62(66)64-41-37-50(47-73(64)76)49-35-39-54(40-36-49)75(71-45-46-72(61-26-10-9-25-60(61)71)78-68-33-17-13-27-58(68)59-28-14-18-34-69(59)78)70-44-43-55(56-23-7-8-24-57(56)70)51-38-42-65-63-30-12-16-32-67(63)77(74(65)48-51)53-21-5-2-6-22-53/h1-48H.
What are the key properties of N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine?
N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine has a molecular weight of 993.23 g/mol, XLogP of 20.09, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylnaphthalen-1-yl)-4-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]naphthalen-1-amine is sourced from PubChem (CID 89213110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).