N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline

C26H23NO — CID 58817048

IUPACN-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline
SMILESCOc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C26H23NO/c1-20-8-12-23(13-9-20)27(25-16-18-26(28-2)19-17-25)24-14-10-22(11-15-24)21-6-4-3-5-7-21/h3-19H,1-2H3
InChIKeyJTZBMJPMXYVVSP-UHFFFAOYSA-N
MW365.48 g/mol
LogP7.14
Rot. Bonds5

About N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline

N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline (PubChem CID 58817048) has the molecular formula C26H23NO and a molecular weight of 365.48 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline
PubChem CID58817048
Molecular FormulaC26H23NO
Molecular Weight365.48 g/mol
Exact Mass365.18
IUPAC NameN-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline
SMILESCOc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C26H23NO/c1-20-8-12-23(13-9-20)27(25-16-18-26(28-2)19-17-25)24-14-10-22(11-15-24)21-6-4-3-5-7-21/h3-19H,1-2H3
InChIKeyJTZBMJPMXYVVSP-UHFFFAOYSA-N
XLogP7.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.48
LogP ≤ 57.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline?
The IUPAC name of N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline (CID 58817048) is N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline?
The canonical SMILES for N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline is COc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline?
The InChIKey is JTZBMJPMXYVVSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23NO/c1-20-8-12-23(13-9-20)27(25-16-18-26(28-2)19-17-25)24-14-10-22(11-15-24)21-6-4-3-5-7-21/h3-19H,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline?
N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline has a molecular weight of 365.48 g/mol, XLogP of 7.14, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-methyl-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 58817048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).