N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline

C31H25N — CID 163746160

IUPACN-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline
SMILESCN(c1ccc(-c2ccccc2)c(-c2ccccc2)c1)c1ccccc1-c1ccccc1
InChIInChI=1S/C31H25N/c1-32(31-20-12-11-19-29(31)25-15-7-3-8-16-25)27-21-22-28(24-13-5-2-6-14-24)30(23-27)26-17-9-4-10-18-26/h2-23H,1H3
InChIKeyCLKQYBZKTVDPMB-UHFFFAOYSA-N
MW411.55 g/mol
LogP8.46
Rot. Bonds5

About N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline

N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline (PubChem CID 163746160) has the molecular formula C31H25N and a molecular weight of 411.55 g/mol. Its IUPAC name is N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline.

Molecular Properties

Compound NameN-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline
PubChem CID163746160
Molecular FormulaC31H25N
Molecular Weight411.55 g/mol
Exact Mass411.20
IUPAC NameN-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline
SMILESCN(c1ccc(-c2ccccc2)c(-c2ccccc2)c1)c1ccccc1-c1ccccc1
InChIInChI=1S/C31H25N/c1-32(31-20-12-11-19-29(31)25-15-7-3-8-16-25)27-21-22-28(24-13-5-2-6-14-24)30(23-27)26-17-9-4-10-18-26/h2-23H,1H3
InChIKeyCLKQYBZKTVDPMB-UHFFFAOYSA-N
XLogP8.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.55
LogP ≤ 58.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-methyl-3,4-diphenyl-N-(2-phenylphenyl)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

N-methyl-N-(2-phenylphenyl)-14-oxatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2(7),3,5,8,10,12,15,17-nonaen-4-amine
CID 130260608
1-N-methyl-3-N,3-N-diphenyl-1-N-(2-phenylphenyl)benzene-1,3-diamine
CID 58903662
N-methyl-N,2-bis(4-phenylphenyl)aniline;propane
CID 145370298
3,4-diphenyl-N-(2-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 174254211
N-methyl-N-(3-naphthalen-2-ylphenyl)-2-phenylaniline
CID 163929020
N-[4-(3,4-diphenylphenyl)phenyl]-N,2-bis(4-phenylphenyl)aniline
CID 164831679
1-N,2-N-bis(3,4-diphenylphenyl)-1-N,2-N-bis(4-phenylphenyl)benzene-1,2-diamine
CID 155010301
N-methyl-2-[2-(N-methylanilino)phenyl]-N-phenylaniline
CID 132560477
N-methyl-5-phenyl-N-(3-phenylphenyl)naphthalen-1-amine
CID 163451473
N-methyl-N-phenyl-3-(3-phenylphenyl)aniline;N-methyl-N-phenyl-3-(4-phenylphenyl)aniline;N-methyl-N-phenyl-4-(2-phenylphenyl)aniline;N-methyl-N-phenyl-4-(3-phenylphenyl)aniline
CID 158130832
azane;N,N-dimethyl-2-phenylaniline
CID 162317872
2-phenyl-N-(4-phenylphenyl)-N-[4-[2-[4-(4-phenyl-N-(2-phenylphenyl)anilino)phenyl]phenyl]phenyl]aniline
CID 121387002

Frequently Asked Questions

What is the IUPAC name of N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline?
The IUPAC name of N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline (CID 163746160) is N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline.
What is the SMILES notation for N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline?
The canonical SMILES for N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline is CN(c1ccc(-c2ccccc2)c(-c2ccccc2)c1)c1ccccc1-c1ccccc1.
What is the InChIKey of N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline?
The InChIKey is CLKQYBZKTVDPMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H25N/c1-32(31-20-12-11-19-29(31)25-15-7-3-8-16-25)27-21-22-28(24-13-5-2-6-14-24)30(23-27)26-17-9-4-10-18-26/h2-23H,1H3.
What are the key properties of N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline?
N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline has a molecular weight of 411.55 g/mol, XLogP of 8.46, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3,4-diphenyl-N-(2-phenylphenyl)aniline is sourced from PubChem (CID 163746160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).