N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine

C58H40N2 — CID 177128422

IUPACN-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4ccc(N(c5ccc(-c6ccccc6)c(-c6ccccc6)c5)c5ccc6ccccc6c5-c5ccccc5)cc43)cc2)cc1
InChIInChI=1S/C58H40N2/c1-5-17-41(18-6-1)42-29-32-47(33-30-42)60-55-28-16-15-27-52(55)53-37-35-49(40-57(53)60)59(56-38-31-45-23-13-14-26-51(45)58(56)46-24-11-4-12-25-46)48-34-36-50(43-19-7-2-8-20-43)54(39-48)44-21-9-3-10-22-44/h1-40H
InChIKeyUZRPMOYJXVWFMS-UHFFFAOYSA-N
MW764.97 g/mol
LogP16.07
Rot. Bonds8

About N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine

N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine (PubChem CID 177128422) has the molecular formula C58H40N2 and a molecular weight of 764.97 g/mol. Its IUPAC name is N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine.

Molecular Properties

Compound NameN-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine
PubChem CID177128422
Molecular FormulaC58H40N2
Molecular Weight764.97 g/mol
Exact Mass764.32
IUPAC NameN-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4ccc(N(c5ccc(-c6ccccc6)c(-c6ccccc6)c5)c5ccc6ccccc6c5-c5ccccc5)cc43)cc2)cc1
InChIInChI=1S/C58H40N2/c1-5-17-41(18-6-1)42-29-32-47(33-30-42)60-55-28-16-15-27-52(55)53-37-35-49(40-57(53)60)59(56-38-31-45-23-13-14-26-51(45)58(56)46-24-11-4-12-25-46)48-34-36-50(43-19-7-2-8-20-43)54(39-48)44-21-9-3-10-22-44/h1-40H
InChIKeyUZRPMOYJXVWFMS-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

N-(3,4-diphenylphenyl)-5-methyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
CID 177128321
N-[4-(2,5-diphenylphenyl)phenyl]-5-methyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
CID 177128347
N-[4-(2,4-diphenylphenyl)phenyl]-5,7-dimethyl-9-phenyl-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
CID 177128376
9-[4-(4-cyclohexylphenyl)phenyl]-N-(2,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)carbazol-2-amine
CID 177128271
N-(4-phenanthren-2-ylphenyl)-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-2-amine
CID 172501369
N-(4-phenylphenyl)-N-[4-[2-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]naphthalen-1-amine
CID 126627984
N-[4-[2-(4-benzo[b]carbazol-5-ylphenyl)phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 134380685
N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9-phenyl-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-2-amine
CID 172501973
N-(2,3-diphenylphenyl)-9-phenyl-N-(6-phenylnaphthalen-2-yl)carbazol-2-amine
CID 165394959
N,9-bis(4-phenylphenyl)-N-[2-(4-phenylphenyl)phenyl]carbazol-2-amine
CID 138668241
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(4-phenanthren-2-ylphenyl)-3-phenyl-2-(2-phenylphenyl)aniline
CID 168790793
9-phenyl-N-[4-(2-phenylphenyl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]carbazol-2-amine
CID 172500939

Frequently Asked Questions

What is the IUPAC name of N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine?
The IUPAC name of N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine (CID 177128422) is N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine.
What is the SMILES notation for N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine?
The canonical SMILES for N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine is c1ccc(-c2ccc(-n3c4ccccc4c4ccc(N(c5ccc(-c6ccccc6)c(-c6ccccc6)c5)c5ccc6ccccc6c5-c5ccccc5)cc43)cc2)cc1.
What is the InChIKey of N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine?
The InChIKey is UZRPMOYJXVWFMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H40N2/c1-5-17-41(18-6-1)42-29-32-47(33-30-42)60-55-28-16-15-27-52(55)53-37-35-49(40-57(53)60)59(56-38-31-45-23-13-14-26-51(45)58(56)46-24-11-4-12-25-46)48-34-36-50(43-19-7-2-8-20-43)54(39-48)44-21-9-3-10-22-44/h1-40H.
What are the key properties of N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine?
N-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-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-(3,4-diphenylphenyl)-N-(1-phenylnaphthalen-2-yl)-9-(4-phenylphenyl)carbazol-2-amine is sourced from PubChem (CID 177128422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).