N-(2-methylphenyl)-2,3-diphenylaniline

C25H21N — CID 154510508

IUPACN-(2-methylphenyl)-2,3-diphenylaniline
SMILESCc1ccccc1Nc1cccc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C25H21N/c1-19-11-8-9-17-23(19)26-24-18-10-16-22(20-12-4-2-5-13-20)25(24)21-14-6-3-7-15-21/h2-18,26H,1H3
InChIKeyAGTWBYQADUXJAS-UHFFFAOYSA-N
MW335.45 g/mol
LogP7.07
Rot. Bonds4

About N-(2-methylphenyl)-2,3-diphenylaniline

N-(2-methylphenyl)-2,3-diphenylaniline (PubChem CID 154510508) has the molecular formula C25H21N and a molecular weight of 335.45 g/mol. Its IUPAC name is N-(2-methylphenyl)-2,3-diphenylaniline.

Molecular Properties

Compound NameN-(2-methylphenyl)-2,3-diphenylaniline
PubChem CID154510508
Molecular FormulaC25H21N
Molecular Weight335.45 g/mol
Exact Mass335.17
IUPAC NameN-(2-methylphenyl)-2,3-diphenylaniline
SMILESCc1ccccc1Nc1cccc(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C25H21N/c1-19-11-8-9-17-23(19)26-24-18-10-16-22(20-12-4-2-5-13-20)25(24)21-14-6-3-7-15-21/h2-18,26H,1H3
InChIKeyAGTWBYQADUXJAS-UHFFFAOYSA-N
XLogP7.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.45
LogP ≤ 57.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-2,3-diphenylbenzene;sulfane
CID 174862423
azane;1-methyl-2,3-diphenylbenzene
CID 175031313
lithium;hydride;1-methyl-2,3-diphenylbenzene
CID 175388205
2-methyl-N-[4-(2-methylphenyl)phenyl]aniline
CID 144650096
1,2-bis(2-methylphenyl)-3-phenylbenzene
CID 175315364
1-N,2-N-bis(2-phenylphenyl)benzene-1,2-diamine
CID 22968504
2-methyl-3-(2-methylphenyl)-N-phenylaniline
CID 145291180
1,2-dimethyl-3-(2-phenylphenyl)benzene
CID 54215466
2-methyl-6-phenylphenol
CID 12592481
1-methyl-2-phenyl-3-(3-phenylphenyl)benzene
CID 59171668
1-methyl-4,8-diphenylazulene
CID 86056773
9,9-dimethyl-N-(2-phenylphenyl)fluoren-4-amine
CID 121358619

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-2,3-diphenylaniline?
The IUPAC name of N-(2-methylphenyl)-2,3-diphenylaniline (CID 154510508) is N-(2-methylphenyl)-2,3-diphenylaniline.
What is the SMILES notation for N-(2-methylphenyl)-2,3-diphenylaniline?
The canonical SMILES for N-(2-methylphenyl)-2,3-diphenylaniline is Cc1ccccc1Nc1cccc(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of N-(2-methylphenyl)-2,3-diphenylaniline?
The InChIKey is AGTWBYQADUXJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N/c1-19-11-8-9-17-23(19)26-24-18-10-16-22(20-12-4-2-5-13-20)25(24)21-14-6-3-7-15-21/h2-18,26H,1H3.
What are the key properties of N-(2-methylphenyl)-2,3-diphenylaniline?
N-(2-methylphenyl)-2,3-diphenylaniline has a molecular weight of 335.45 g/mol, XLogP of 7.07, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-2,3-diphenylaniline is sourced from PubChem (CID 154510508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).