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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine

C150H102N6 — CID 159554743

IUPACN-(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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cc4c5ccccc5n(-c5ccccc5)c4c4ccccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(ccc5c6ccccc6n(-c6ccccc6)c45)c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4c3ccc3c5ccccc5n(-c5ccccc5)c43)cc2)cc1
InChIInChI=1S/3C50H34N2/c1-3-13-35(14-4-1)37-25-29-42(30-26-37)51(43-31-27-38(28-32-43)40-24-23-36-15-7-8-16-39(36)33-40)49-34-47-45-20-11-12-22-48(45)52(41-17-5-2-6-18-41)50(47)46-21-10-9-19-44(46)49;1-3-12-35(13-4-1)37-24-28-42(29-25-37)51(43-30-26-38(27-31-43)40-23-22-36-14-7-8-15-39(36)34-40)48-21-11-19-46-45(48)32-33-47-44-18-9-10-20-49(44)52(50(46)47)41-16-5-2-6-17-41;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
InChIKeyMFVNAAQQQFVMDV-UHFFFAOYSA-N
MW1988.51 g/mol
LogP41.68
Rot. Bonds18

About 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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine (PubChem CID 159554743) 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-3-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine.

Molecular Properties

Compound NameN-(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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine
PubChem CID159554743
Molecular FormulaC150H102N6
Molecular Weight1988.51 g/mol
Exact Mass1986.82
IUPAC NameN-(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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cc4c5ccccc5n(-c5ccccc5)c4c4ccccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(ccc5c6ccccc6n(-c6ccccc6)c45)c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4c3ccc3c5ccccc5n(-c5ccccc5)c43)cc2)cc1
InChIInChI=1S/3C50H34N2/c1-3-13-35(14-4-1)37-25-29-42(30-26-37)51(43-31-27-38(28-32-43)40-24-23-36-15-7-8-16-39(36)33-40)49-34-47-45-20-11-12-22-48(45)52(41-17-5-2-6-18-41)50(47)46-21-10-9-19-44(46)49;1-3-12-35(13-4-1)37-24-28-42(29-25-37)51(43-30-26-38(27-31-43)40-23-22-36-14-7-8-15-39(36)34-40)48-21-11-19-46-45(48)32-33-47-44-18-9-10-20-49(44)52(50(46)47)41-16-5-2-6-17-41;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
InChIKeyMFVNAAQQQFVMDV-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-3-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-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-3-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine?
The IUPAC name of 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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine (CID 159554743) is 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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine.
What is the SMILES notation for 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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine?
The canonical SMILES for 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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cc4c5ccccc5n(-c5ccccc5)c4c4ccccc34)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(ccc5c6ccccc6n(-c6ccccc6)c45)c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4c3ccc3c5ccccc5n(-c5ccccc5)c43)cc2)cc1.
What is the InChIKey of 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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine?
The InChIKey is MFVNAAQQQFVMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/3C50H34N2/c1-3-13-35(14-4-1)37-25-29-42(30-26-37)51(43-31-27-38(28-32-43)40-24-23-36-15-7-8-16-39(36)33-40)49-34-47-45-20-11-12-22-48(45)52(41-17-5-2-6-18-41)50(47)46-21-10-9-19-44(46)49;1-3-12-35(13-4-1)37-24-28-42(29-25-37)51(43-30-26-38(27-31-43)40-23-22-36-14-7-8-15-39(36)34-40)48-21-11-19-46-45(48)32-33-47-44-18-9-10-20-49(44)52(50(46)47)41-16-5-2-6-17-41;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-3-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-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-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-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-3-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-4-amine;N-(4-naphthalen-2-ylphenyl)-11-phenyl-N-(4-phenylphenyl)benzo[a]carbazol-5-amine is sourced from PubChem (CID 159554743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).