N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline

C165H117N9 — CID 159011512

IUPACN,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline
SMILESCc1ccc(N(c2ccc(C)cc2)c2cccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)c2)cc1.Cc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc3n4-c3ccccc3)ccc1n2-c1ccccc1.c1ccc(N(c2ccccc2)c2cccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)c2)cc1
InChIInChI=1S/C56H41N3.C55H39N3.C54H37N3/c1-38-20-27-46(28-21-38)57(47-29-22-39(2)23-30-47)48-17-11-12-40(34-48)41-24-32-55-51(36-41)52-37-43(26-33-56(52)59(55)45-15-7-4-8-16-45)42-25-31-54-50(35-42)49-18-9-10-19-53(49)58(54)44-13-5-3-6-14-44;1-38-22-30-52-48(34-38)49-36-41(26-32-53(49)57(52)45-18-10-4-11-19-45)42-27-33-55-51(37-42)50-35-40(25-31-54(50)58(55)46-20-12-5-13-21-46)39-23-28-47(29-24-39)56(43-14-6-2-7-15-43)44-16-8-3-9-17-44;1-5-17-42(18-6-1)55(43-19-7-2-8-20-43)46-25-15-16-38(34-46)39-28-32-53-49(36-39)50-37-41(30-33-54(50)57(53)45-23-11-4-12-24-45)40-29-31-52-48(35-40)47-26-13-14-27-51(47)56(52)44-21-9-3-10-22-44/h3-37H,1-2H3;2-37H,1H3;1-37H
InChIKeyJSNWBZQYOKLEDA-UHFFFAOYSA-N
MW2225.81 g/mol
LogP44.98
Rot. Bonds21

About N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline

N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline (PubChem CID 159011512) has the molecular formula C165H117N9 and a molecular weight of 2225.81 g/mol. Its IUPAC name is N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline.

Molecular Properties

Compound NameN,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline
PubChem CID159011512
Molecular FormulaC165H117N9
Molecular Weight2225.81 g/mol
Exact Mass2223.94
IUPAC NameN,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline
SMILESCc1ccc(N(c2ccc(C)cc2)c2cccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)c2)cc1.Cc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc3n4-c3ccccc3)ccc1n2-c1ccccc1.c1ccc(N(c2ccccc2)c2cccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)c2)cc1
InChIInChI=1S/C56H41N3.C55H39N3.C54H37N3/c1-38-20-27-46(28-21-38)57(47-29-22-39(2)23-30-47)48-17-11-12-40(34-48)41-24-32-55-51(36-41)52-37-43(26-33-56(52)59(55)45-15-7-4-8-16-45)42-25-31-54-50(35-42)49-18-9-10-19-53(49)58(54)44-13-5-3-6-14-44;1-38-22-30-52-48(34-38)49-36-41(26-32-53(49)57(52)45-18-10-4-11-19-45)42-27-33-55-51(37-42)50-35-40(25-31-54(50)58(55)46-20-12-5-13-21-46)39-23-28-47(29-24-39)56(43-14-6-2-7-15-43)44-16-8-3-9-17-44;1-5-17-42(18-6-1)55(43-19-7-2-8-20-43)46-25-15-16-38(34-46)39-28-32-53-49(36-39)50-37-41(30-33-54(50)57(53)45-23-11-4-12-24-45)40-29-31-52-48(35-40)47-26-13-14-27-51(47)56(52)44-21-9-3-10-22-44/h3-37H,1-2H3;2-37H,1H3;1-37H
InChIKeyJSNWBZQYOKLEDA-UHFFFAOYSA-N
XLogP44.98
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds21
Heavy Atoms174
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002225.81
LogP ≤ 544.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline with MolForge

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Related Compounds

N,N-bis[4-(4-carbazol-9-ylphenyl)phenyl]-4-phenylaniline;3,6-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-9-(4-phenylphenyl)carbazole
CID 159617132
3-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 161050252
4-N-[3-[3,5-bis(9-phenylcarbazol-3-yl)phenyl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;1-N,1-N,3-N,3-N-tetrakis(4-methylphenyl)-5-[3-phenyl-5-[6-phenyl-9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 162228540
N-[4-[4-(3-phenylcarbazol-9-yl)phenyl]phenyl]-3-(4-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]aniline
CID 121312772
N,N-bis[4-(4-carbazol-9-ylphenyl)phenyl]-4-phenylaniline;3,6-bis[4-(3,6-dimethylcarbazol-9-yl)phenyl]-9-(4-phenylphenyl)carbazole;9-[4-[3-(4-carbazol-9-ylphenyl)-5-phenylphenyl]phenyl]carbazole
CID 160896823
1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]-3-N-[4-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 177275836
1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]-3-N-[3-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 177275807
N-[4-[9-(3-carbazol-9-ylphenyl)carbazol-3-yl]phenyl]-3-methyl-N-(3-methylphenyl)aniline;N-[4-[9-(3-carbazol-9-ylphenyl)carbazol-3-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 159634715
N-(4-methylphenyl)-N-phenyl-9-(4-phenylphenyl)carbazol-3-amine
CID 153303724
6-[3-[3-methyl-5-(4-phenyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]-N,9-diphenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 163787508
N-[4-(9-phenylcarbazol-3-yl)phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 59469837
N-[4-[3-carbazol-9-yl-6-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]carbazol-9-yl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 156545359

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline?
The IUPAC name of N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline (CID 159011512) is N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline.
What is the SMILES notation for N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline?
The canonical SMILES for N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline is Cc1ccc(N(c2ccc(C)cc2)c2cccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)c2)cc1.Cc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc3n4-c3ccccc3)ccc1n2-c1ccccc1.c1ccc(N(c2ccccc2)c2cccc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc3n4-c3ccccc3)c2)cc1.
What is the InChIKey of N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline?
The InChIKey is JSNWBZQYOKLEDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H41N3.C55H39N3.C54H37N3/c1-38-20-27-46(28-21-38)57(47-29-22-39(2)23-30-47)48-17-11-12-40(34-48)41-24-32-55-51(36-41)52-37-43(26-33-56(52)59(55)45-15-7-4-8-16-45)42-25-31-54-50(35-42)49-18-9-10-19-53(49)58(54)44-13-5-3-6-14-44;1-38-22-30-52-48(34-38)49-36-41(26-32-53(49)57(52)45-18-10-4-11-19-45)42-27-33-55-51(37-42)50-35-40(25-31-54(50)58(55)46-20-12-5-13-21-46)39-23-28-47(29-24-39)56(43-14-6-2-7-15-43)44-16-8-3-9-17-44;1-5-17-42(18-6-1)55(43-19-7-2-8-20-43)46-25-15-16-38(34-46)39-28-32-53-49(36-39)50-37-41(30-33-54(50)57(53)45-23-11-4-12-24-45)40-29-31-52-48(35-40)47-26-13-14-27-51(47)56(52)44-21-9-3-10-22-44/h3-37H,1-2H3;2-37H,1H3;1-37H.
What are the key properties of N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline?
N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline has a molecular weight of 2225.81 g/mol, XLogP of 44.98, 21 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline is sourced from PubChem (CID 159011512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).