N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline

C26H23N — CID 143685330

IUPACN-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline
SMILESCc1ccc(-c2ccc(N(C)c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C26H23N/c1-20-8-10-22(11-9-20)24-14-18-26(19-15-24)27(2)25-16-12-23(13-17-25)21-6-4-3-5-7-21/h3-19H,1-2H3
InChIKeyJSRYLTWZUQYURY-UHFFFAOYSA-N
MW349.48 g/mol
LogP7.10
Rot. Bonds4

About N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline

N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline (PubChem CID 143685330) has the molecular formula C26H23N and a molecular weight of 349.48 g/mol. Its IUPAC name is N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline.

Molecular Properties

Compound NameN-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline
PubChem CID143685330
Molecular FormulaC26H23N
Molecular Weight349.48 g/mol
Exact Mass349.18
IUPAC NameN-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline
SMILESCc1ccc(-c2ccc(N(C)c3ccc(-c4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C26H23N/c1-20-8-10-22(11-9-20)24-14-18-26(19-15-24)27(2)25-16-12-23(13-17-25)21-6-4-3-5-7-21/h3-19H,1-2H3
InChIKeyJSRYLTWZUQYURY-UHFFFAOYSA-N
XLogP7.10
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.48
LogP ≤ 57.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-methyl-N-[4-(4-methylphenyl)phenyl]-4-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-methyl-N-phenylaniline;1-methyl-4-(4-phenylphenyl)benzene;1-methyl-4-[4-(4-phenylphenyl)phenyl]benzene;1-methyl-4-[4-[4-(4-phenylphenyl)phenyl]phenyl]benzene
CID 157193805
benzene;N,4-dimethyl-N-phenylaniline
CID 71196716
N-methyl-N-phenylaniline;N-methyl-4-phenyl-N-(4-phenylphenyl)aniline
CID 157333767
N-methyl-4-[3-(4-methylphenyl)phenyl]-N-phenylaniline
CID 58151391
N,4-dimethyl-N-phenylaniline;ethane;toluene
CID 143203824
4-N-[4-[4-(N,4-dimethylanilino)-N-methylanilino]phenyl]-1-N,4-N-dimethyl-1-N-(4-methylphenyl)benzene-1,4-diamine
CID 90265189
1-N-methyl-1-N,4-N-bis(4-methylphenyl)-4-N-phenylbenzene-1,4-diamine
CID 59431689
1-N-methyl-4-N-[4-(N-(4-methylphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine
CID 58038448
4-methyl-N-[4-[4-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 19604781
N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline
CID 145100467
N-[4-[4-(N-methylanilino)phenoxy]phenyl]-4-(4-methylphenyl)-N-phenylaniline
CID 23593163
N-(4-tert-butylphenyl)-N-methyl-4-phenylaniline
CID 70891344

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline?
The IUPAC name of N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline (CID 143685330) is N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline.
What is the SMILES notation for N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline?
The canonical SMILES for N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline is Cc1ccc(-c2ccc(N(C)c3ccc(-c4ccccc4)cc3)cc2)cc1.
What is the InChIKey of N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline?
The InChIKey is JSRYLTWZUQYURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N/c1-20-8-10-22(11-9-20)24-14-18-26(19-15-24)27(2)25-16-12-23(13-17-25)21-6-4-3-5-7-21/h3-19H,1-2H3.
What are the key properties of N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline?
N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline has a molecular weight of 349.48 g/mol, XLogP of 7.10, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline is sourced from PubChem (CID 143685330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).