N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline

C67H48N2 — CID 143088757

IUPACN-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline
SMILESCc1ccccc1N(c1ccccc1)c1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccccc3)c2-c2ccccc2)cc1
InChIInChI=1S/C67H48N2/c1-47-23-17-20-36-59(47)68(54-32-15-6-16-33-54)55-43-39-52(40-44-55)66-62(48-24-7-2-8-25-48)64(50-28-11-4-12-29-50)67(65(51-30-13-5-14-31-51)63(66)49-26-9-3-10-27-49)53-41-45-56(46-42-53)69-60-37-21-18-34-57(60)58-35-19-22-38-61(58)69/h2-46H,1H3
InChIKeyNJOVCLXAESMJEP-UHFFFAOYSA-N
MW881.14 g/mol
LogP18.56
Rot. Bonds10

About N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline

N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline (PubChem CID 143088757) has the molecular formula C67H48N2 and a molecular weight of 881.14 g/mol. Its IUPAC name is N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline.

Molecular Properties

Compound NameN-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline
PubChem CID143088757
Molecular FormulaC67H48N2
Molecular Weight881.14 g/mol
Exact Mass880.38
IUPAC NameN-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline
SMILESCc1ccccc1N(c1ccccc1)c1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccccc3)c2-c2ccccc2)cc1
InChIInChI=1S/C67H48N2/c1-47-23-17-20-36-59(47)68(54-32-15-6-16-33-54)55-43-39-52(40-44-55)66-62(48-24-7-2-8-25-48)64(50-28-11-4-12-29-50)67(65(51-30-13-5-14-31-51)63(66)49-26-9-3-10-27-49)53-41-45-56(46-42-53)69-60-37-21-18-34-57(60)58-35-19-22-38-61(58)69/h2-46H,1H3
InChIKeyNJOVCLXAESMJEP-UHFFFAOYSA-N
XLogP18.56
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms69
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500881.14
LogP ≤ 518.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline 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-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline;ethane
CID 143088756
2-(4-carbazol-9-ylphenyl)-1-N-(2-methylphenyl)-1-N,4-N,4-N-triphenylbenzene-1,4-diamine
CID 145060262
4-(4-carbazol-9-ylphenyl)-N-phenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]aniline
CID 175169513
N-[4-[4-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 156545419
N-(4-carbazol-9-ylphenyl)-4-(2-methyl-10-phenylanthracen-9-yl)-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-(3-methyl-10-phenylanthracen-9-yl)-N-phenylaniline
CID 158366051
4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;4-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)-N-phenylaniline;9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 160833805
N,4-bis(4-carbazol-9-ylphenyl)-N-phenylaniline
CID 90296019
2-(4-carbazol-9-ylphenyl)-N,N-bis(4-phenylphenyl)aniline
CID 121329642
9-(4-methylphenyl)-N,N-bis(4-phenylphenyl)carbazol-4-amine
CID 90377540
N-[4-[4-[3,6-bis(4-carbazol-9-ylphenyl)carbazol-9-yl]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 118402405
3,6-bis(4-carbazol-9-ylphenyl)-9-(4-phenylphenyl)carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-9-(4-phenylphenyl)carbazol-3-yl]aniline
CID 158023150
N-(4-carbazol-9-ylphenyl)-N-phenyl-9-(4-phenylphenyl)carbazol-3-amine
CID 129061469

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline?
The IUPAC name of N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline (CID 143088757) is N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline.
What is the SMILES notation for N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline?
The canonical SMILES for N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline is Cc1ccccc1N(c1ccccc1)c1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccccc3)c2-c2ccccc2)cc1.
What is the InChIKey of N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline?
The InChIKey is NJOVCLXAESMJEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H48N2/c1-47-23-17-20-36-59(47)68(54-32-15-6-16-33-54)55-43-39-52(40-44-55)66-62(48-24-7-2-8-25-48)64(50-28-11-4-12-29-50)67(65(51-30-13-5-14-31-51)63(66)49-26-9-3-10-27-49)53-41-45-56(46-42-53)69-60-37-21-18-34-57(60)58-35-19-22-38-61(58)69/h2-46H,1H3.
What are the key properties of N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline?
N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline has a molecular weight of 881.14 g/mol, XLogP of 18.56, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetraphenylphenyl]phenyl]-2-methyl-N-phenylaniline is sourced from PubChem (CID 143088757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).