N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine

C60H40N4 — CID 59211049

IUPACN-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine
SMILESc1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccccc4-c4ccccn4)c4ccccc4c(-c4ccccc4-c4ccccn4)c3c2)cc1
InChIInChI=1S/C60H40N4/c1-2-18-41(19-3-1)63(42-32-34-43(35-33-42)64-57-30-12-10-22-47(57)48-23-11-13-31-58(48)64)44-36-37-53-54(40-44)60(50-25-7-5-21-46(50)56-29-15-17-39-62-56)52-27-9-8-26-51(52)59(53)49-24-6-4-20-45(49)55-28-14-16-38-61-55/h1-40H
InChIKeyZMJFXLRFYOZRPC-UHFFFAOYSA-N
MW817.01 g/mol
LogP16.02
Rot. Bonds8

About N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine

N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine (PubChem CID 59211049) has the molecular formula C60H40N4 and a molecular weight of 817.01 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine
PubChem CID59211049
Molecular FormulaC60H40N4
Molecular Weight817.01 g/mol
Exact Mass816.33
IUPAC NameN-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine
SMILESc1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccccc4-c4ccccn4)c4ccccc4c(-c4ccccc4-c4ccccn4)c3c2)cc1
InChIInChI=1S/C60H40N4/c1-2-18-41(19-3-1)63(42-32-34-43(35-33-42)64-57-30-12-10-22-47(57)48-23-11-13-31-58(48)64)44-36-37-53-54(40-44)60(50-25-7-5-21-46(50)56-29-15-17-39-62-56)52-27-9-8-26-51(52)59(53)49-24-6-4-20-45(49)55-28-14-16-38-61-55/h1-40H
InChIKeyZMJFXLRFYOZRPC-UHFFFAOYSA-N
XLogP16.02
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500817.01
LogP ≤ 516.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(3-pyridin-2-ylphenyl)anthracen-2-amine
CID 59211181
N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(4-pyridin-2-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(4-pyridin-2-ylphenyl)anthracen-2-amine
CID 158911182
2-[3-(N-(4-carbazol-9-ylphenyl)anilino)-10-(2-cyanophenyl)anthracen-9-yl]benzonitrile
CID 88569872
3-N,3-N,6-N,6-N-tetraphenyl-9-[4-(4-pyridin-2-ylphenyl)phenyl]carbazole-3,6-diamine
CID 130354274
N-[9,10-bis(3-pyridin-2-ylphenyl)anthracen-1-yl]-N,9-diphenylcarbazol-3-amine;N-[9,10-bis(3-pyridin-2-ylphenyl)anthracen-2-yl]-N,9-diphenylcarbazol-3-amine
CID 162236994
N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine
CID 161402037
9-(6-carbazol-9-yl-9,10-dipyridin-2-ylanthracen-2-yl)carbazole
CID 59221065
2-[10-(2-cyanophenyl)-3-(N-(9-phenylcarbazol-3-yl)anilino)anthracen-9-yl]benzonitrile
CID 88569846
4-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-N-phenylaniline
CID 20607981
N-[9,10-bis(4-quinolin-6-ylphenyl)anthracen-2-yl]-N,9-diphenylcarbazol-3-amine
CID 59211188
N,N-diphenyl-9-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazol-3-amine;N,N-diphenyl-9-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]carbazol-3-amine
CID 157146529
N,N-diphenyl-9-[4-[7-[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]-1,10-phenanthrolin-4-yl]phenyl]carbazol-3-amine
CID 135252609

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine (CID 59211049) is N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine is c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccccc4-c4ccccn4)c4ccccc4c(-c4ccccc4-c4ccccn4)c3c2)cc1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine?
The InChIKey is ZMJFXLRFYOZRPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N4/c1-2-18-41(19-3-1)63(42-32-34-43(35-33-42)64-57-30-12-10-22-47(57)48-23-11-13-31-58(48)64)44-36-37-53-54(40-44)60(50-25-7-5-21-46(50)56-29-15-17-39-62-56)52-27-9-8-26-51(52)59(53)49-24-6-4-20-45(49)55-28-14-16-38-61-55/h1-40H.
What are the key properties of N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine?
N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine has a molecular weight of 817.01 g/mol, XLogP of 16.02, 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-ylphenyl)-N-phenyl-9,10-bis(2-pyridin-2-ylphenyl)anthracen-2-amine is sourced from PubChem (CID 59211049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).