4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline

C42H30N2 — CID 121262045

IUPAC4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline
SMILESc1ccc(Nc2ccc(-c3ccc4[nH]c5ccccc5c4c3)cc2-c2ccc(-c3cccc(-c4ccccc4)c3)cc2)cc1
InChIInChI=1S/C42H30N2/c1-3-10-29(11-4-1)32-12-9-13-33(26-32)30-18-20-31(21-19-30)38-27-34(22-24-41(38)43-36-14-5-2-6-15-36)35-23-25-42-39(28-35)37-16-7-8-17-40(37)44-42/h1-28,43-44H
InChIKeyRANNHHYBCVFDIY-UHFFFAOYSA-N
MW562.72 g/mol
LogP11.73
Rot. Bonds6

About 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline

4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline (PubChem CID 121262045) has the molecular formula C42H30N2 and a molecular weight of 562.72 g/mol. Its IUPAC name is 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline.

Molecular Properties

Compound Name4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline
PubChem CID121262045
Molecular FormulaC42H30N2
Molecular Weight562.72 g/mol
Exact Mass562.24
IUPAC Name4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline
SMILESc1ccc(Nc2ccc(-c3ccc4[nH]c5ccccc5c4c3)cc2-c2ccc(-c3cccc(-c4ccccc4)c3)cc2)cc1
InChIInChI=1S/C42H30N2/c1-3-10-29(11-4-1)32-12-9-13-33(26-32)30-18-20-31(21-19-30)38-27-34(22-24-41(38)43-36-14-5-2-6-15-36)35-23-25-42-39(28-35)37-16-7-8-17-40(37)44-42/h1-28,43-44H
InChIKeyRANNHHYBCVFDIY-UHFFFAOYSA-N
XLogP11.73
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.72
LogP ≤ 511.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline 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

3-[4-(9H-carbazol-3-yl)-2-phenylanilino]benzonitrile
CID 129238384
N,2-diphenyl-4-[3-phenyl-4-[4-(4-phenylphenyl)anilino]phenyl]aniline
CID 121262444
2,4-diphenyl-N-(3-phenylphenyl)aniline
CID 90153748
4-[4-(3,5-diphenylanilino)-3-phenylphenyl]-2-phenyl-N-(4-phenylphenyl)aniline
CID 118907736
3-(3,5-diphenylphenyl)-6-phenyl-9H-carbazole
CID 176723947
N-[2-phenyl-4-[5-(4-phenylphenyl)-7H-indolo[2,3-b]carbazol-2-yl]phenyl]naphthalen-2-amine
CID 121343805
2-(3-phenylphenyl)-9H-carbazole
CID 135143847
4-[5-[3-(6-methylcyclohexa-1,3-dien-1-yl)phenyl]-7H-indolo[2,3-b]carbazol-2-yl]-N,2-diphenylaniline
CID 121344049
2-phenyl-N-(4-phenylphenyl)-4-(3,4,5-triphenylphenyl)aniline
CID 155123182
ethane;methanethiol;N-(4-naphthalen-1-ylphenyl)-2,4-diphenylaniline
CID 145442322
4-(9H-carbazol-3-yl)-N-(4-dibenzothiophen-2-ylphenyl)aniline
CID 145299761
4-[3-[2-phenyl-4-[4-(3-phenylphenyl)phenyl]anilino]phenyl]benzonitrile
CID 118682618

Frequently Asked Questions

What is the IUPAC name of 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline?
The IUPAC name of 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline (CID 121262045) is 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline.
What is the SMILES notation for 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline?
The canonical SMILES for 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline is c1ccc(Nc2ccc(-c3ccc4[nH]c5ccccc5c4c3)cc2-c2ccc(-c3cccc(-c4ccccc4)c3)cc2)cc1.
What is the InChIKey of 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline?
The InChIKey is RANNHHYBCVFDIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H30N2/c1-3-10-29(11-4-1)32-12-9-13-33(26-32)30-18-20-31(21-19-30)38-27-34(22-24-41(38)43-36-14-5-2-6-15-36)35-23-25-42-39(28-35)37-16-7-8-17-40(37)44-42/h1-28,43-44H.
What are the key properties of 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline?
4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline has a molecular weight of 562.72 g/mol, XLogP of 11.73, 6 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9H-carbazol-3-yl)-N-phenyl-2-[4-(3-phenylphenyl)phenyl]aniline is sourced from PubChem (CID 121262045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).