N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline

C48H34N2 — CID 166134777

IUPACN-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline
SMILESc1ccc(-c2ccccc2N(c2ccccc2)c2ccccc2-c2c(-c3ccccc3)c(-c3ccccc3)cc3c2[nH]c2ccccc23)cc1
InChIInChI=1S/C48H34N2/c1-5-19-34(20-6-1)38-27-14-17-31-44(38)50(37-25-11-4-12-26-37)45-32-18-15-29-40(45)47-46(36-23-9-3-10-24-36)41(35-21-7-2-8-22-35)33-42-39-28-13-16-30-43(39)49-48(42)47/h1-33,49H
InChIKeyYBDISCBNVKGAPC-UHFFFAOYSA-N
MW638.81 g/mol
LogP13.46
Rot. Bonds7

About N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline

N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline (PubChem CID 166134777) has the molecular formula C48H34N2 and a molecular weight of 638.81 g/mol. Its IUPAC name is N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline.

Molecular Properties

Compound NameN-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline
PubChem CID166134777
Molecular FormulaC48H34N2
Molecular Weight638.81 g/mol
Exact Mass638.27
IUPAC NameN-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline
SMILESc1ccc(-c2ccccc2N(c2ccccc2)c2ccccc2-c2c(-c3ccccc3)c(-c3ccccc3)cc3c2[nH]c2ccccc23)cc1
InChIInChI=1S/C48H34N2/c1-5-19-34(20-6-1)38-27-14-17-31-44(38)50(37-25-11-4-12-26-37)45-32-18-15-29-40(45)47-46(36-23-9-3-10-24-36)41(35-21-7-2-8-22-35)33-42-39-28-13-16-30-43(39)49-48(42)47/h1-33,49H
InChIKeyYBDISCBNVKGAPC-UHFFFAOYSA-N
XLogP13.46
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.81
LogP ≤ 513.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline 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,N-diphenyl-2-[3-phenyl-1-[2-(N-phenylanilino)phenyl]-9H-carbazol-2-yl]aniline
CID 166133960
N-[2-(9H-carbazol-3-yl)phenyl]-N,2-diphenylaniline
CID 148771233
N-[2-(2-naphthalen-1-yl-9H-carbazol-1-yl)phenyl]-2-phenyl-N-(2-phenylphenyl)aniline
CID 166133613
2-(9H-carbazol-1-yl)-N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N,6-diphenylaniline
CID 166135032
3-(9H-carbazol-1-yl)-N,N-bis[4-(9H-carbazol-1-yl)phenyl]aniline
CID 141212248
6-phenyl-5H-benzo[b]carbazole
CID 10756140
N,2-diphenyl-N-(2-phenylphenyl)-4-[3-phenyl-4-(N-(2-phenylphenyl)anilino)phenyl]aniline
CID 121322799
1-N,1-N,3-N,5-N,5-N-pentakis-phenyl-3-N-(2-phenylphenyl)benzene-1,3,5-triamine
CID 164813791
2-phenyl-N-[4-(10-phenylphenanthren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 155304911
N-[2-(9H-carbazol-1-yl)-6-phenylphenyl]-N-(2-phenylphenyl)dibenzofuran-1-amine
CID 166134940
2-(9H-carbazol-1-yl)-N,N-bis[2-(9H-carbazol-1-yl)phenyl]aniline
CID 68812374
N,3-diphenyl-N,2-bis(2-phenylphenyl)aniline
CID 168788803

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline?
The IUPAC name of N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline (CID 166134777) is N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline.
What is the SMILES notation for N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline?
The canonical SMILES for N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline is c1ccc(-c2ccccc2N(c2ccccc2)c2ccccc2-c2c(-c3ccccc3)c(-c3ccccc3)cc3c2[nH]c2ccccc23)cc1.
What is the InChIKey of N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline?
The InChIKey is YBDISCBNVKGAPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34N2/c1-5-19-34(20-6-1)38-27-14-17-31-44(38)50(37-25-11-4-12-26-37)45-32-18-15-29-40(45)47-46(36-23-9-3-10-24-36)41(35-21-7-2-8-22-35)33-42-39-28-13-16-30-43(39)49-48(42)47/h1-33,49H.
What are the key properties of N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline?
N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline has a molecular weight of 638.81 g/mol, XLogP of 13.46, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,3-diphenyl-9H-carbazol-1-yl)phenyl]-N,2-diphenylaniline is sourced from PubChem (CID 166134777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).