N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine

C150H102N6 — CID 163713790

IUPACN-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(ccc5c6ccccc6n(-c6ccccc6)c45)c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4ccc5c6ccccc6n(-c6ccccc6)c5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4ccc5c6ccccc6n(-c6ccccc6)c5c34)cc2)cc1
InChIInChI=1S/3C50H34N2/c1-3-12-35(13-4-1)37-24-29-43(30-25-37)51(44-31-26-38(27-32-44)41-23-22-36-14-7-8-15-40(36)34-41)48-21-11-16-39-28-33-46-45-19-9-10-20-47(45)52(50(46)49(39)48)42-17-5-2-6-18-42;1-3-11-35(12-4-1)37-21-27-43(28-22-37)51(44-29-23-38(24-30-44)41-20-19-36-13-7-8-14-40(36)33-41)45-31-25-39-26-32-47-46-17-9-10-18-49(46)52(50(47)48(39)34-45)42-15-5-2-6-16-42;1-3-11-35(12-4-1)37-21-26-43(27-22-37)51(44-28-23-38(24-29-44)40-20-19-36-13-7-8-14-39(36)33-40)45-30-32-46-41(34-45)25-31-48-47-17-9-10-18-49(47)52(50(46)48)42-15-5-2-6-16-42/h3*1-34H
InChIKeyKLNVDIMKPJEUNI-UHFFFAOYSA-N
MW1988.51 g/mol
LogP41.68
Rot. Bonds18

About N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine

N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine (PubChem CID 163713790) has the molecular formula C150H102N6 and a molecular weight of 1988.51 g/mol. Its IUPAC name is N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine.

Molecular Properties

Compound NameN-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine
PubChem CID163713790
Molecular FormulaC150H102N6
Molecular Weight1988.51 g/mol
Exact Mass1986.82
IUPAC NameN-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(ccc5c6ccccc6n(-c6ccccc6)c45)c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4ccc5c6ccccc6n(-c6ccccc6)c5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4ccc5c6ccccc6n(-c6ccccc6)c5c34)cc2)cc1
InChIInChI=1S/3C50H34N2/c1-3-12-35(13-4-1)37-24-29-43(30-25-37)51(44-31-26-38(27-32-44)41-23-22-36-14-7-8-15-40(36)34-41)48-21-11-16-39-28-33-46-45-19-9-10-20-47(45)52(50(46)49(39)48)42-17-5-2-6-18-42;1-3-11-35(12-4-1)37-21-27-43(28-22-37)51(44-29-23-38(24-30-44)41-20-19-36-13-7-8-14-40(36)33-41)45-31-25-39-26-32-47-46-17-9-10-18-49(46)52(50(47)48(39)34-45)42-15-5-2-6-16-42;1-3-11-35(12-4-1)37-21-26-43(27-22-37)51(44-28-23-38(24-29-44)40-20-19-36-13-7-8-14-39(36)33-40)45-30-32-46-41(34-45)25-31-48-47-17-9-10-18-49(47)52(50(46)48)42-15-5-2-6-16-42/h3*1-34H
InChIKeyKLNVDIMKPJEUNI-UHFFFAOYSA-N
XLogP41.68
TPSA24.51 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms156
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001988.51
LogP ≤ 541.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine?
The IUPAC name of N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine (CID 163713790) is N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine.
What is the SMILES notation for N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine?
The canonical SMILES for N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(ccc5c6ccccc6n(-c6ccccc6)c45)c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4ccc5c6ccccc6n(-c6ccccc6)c5c4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4ccc5c6ccccc6n(-c6ccccc6)c5c34)cc2)cc1.
What is the InChIKey of N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine?
The InChIKey is KLNVDIMKPJEUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C50H34N2/c1-3-12-35(13-4-1)37-24-29-43(30-25-37)51(44-31-26-38(27-32-44)41-23-22-36-14-7-8-15-40(36)34-41)48-21-11-16-39-28-33-46-45-19-9-10-20-47(45)52(50(46)49(39)48)42-17-5-2-6-18-42;1-3-11-35(12-4-1)37-21-27-43(28-22-37)51(44-29-23-38(24-30-44)41-20-19-36-13-7-8-14-40(36)33-41)45-31-25-39-26-32-47-46-17-9-10-18-49(46)52(50(47)48(39)34-45)42-15-5-2-6-16-42;1-3-11-35(12-4-1)37-21-26-43(27-22-37)51(44-28-23-38(24-29-44)40-20-19-36-13-7-8-14-39(36)33-40)45-30-32-46-41(34-45)25-31-48-47-17-9-10-18-49(47)52(50(46)48)42-15-5-2-6-16-42/h3*1-34H.
What are the key properties of N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine?
N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine has a molecular weight of 1988.51 g/mol, XLogP of 41.68, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-1-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-2-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-3-amine is sourced from PubChem (CID 163713790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).