2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline

C30H23N — CID 90370372

IUPAC2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline
SMILESc1ccc(-c2cccc(-c3ccccc3Nc3ccccc3-c3ccccc3)c2)cc1
InChIInChI=1S/C30H23N/c1-3-12-23(13-4-1)25-16-11-17-26(22-25)28-19-8-10-21-30(28)31-29-20-9-7-18-27(29)24-14-5-2-6-15-24/h1-22,31H
InChIKeyWHUQJUNPTMRNGG-UHFFFAOYSA-N
MW397.52 g/mol
LogP8.43
Rot. Bonds5

About 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline

2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline (PubChem CID 90370372) has the molecular formula C30H23N and a molecular weight of 397.52 g/mol. Its IUPAC name is 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline.

Molecular Properties

Compound Name2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline
PubChem CID90370372
Molecular FormulaC30H23N
Molecular Weight397.52 g/mol
Exact Mass397.18
IUPAC Name2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline
SMILESc1ccc(-c2cccc(-c3ccccc3Nc3ccccc3-c3ccccc3)c2)cc1
InChIInChI=1S/C30H23N/c1-3-12-23(13-4-1)25-16-11-17-26(22-25)28-19-8-10-21-30(28)31-29-20-9-7-18-27(29)24-14-5-2-6-15-24/h1-22,31H
InChIKeyWHUQJUNPTMRNGG-UHFFFAOYSA-N
XLogP8.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.52
LogP ≤ 58.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Phenyl-1-naphthylamine
CID 7013
Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-
CID 82343
N,N'-Di(2-naphthyl)-p-phenylenediamine
CID 7142
1,2-Dihydro-2,2,4-trimethyl-6-phenylquinoline
CID 77098
N,N'-Diphenylbenzidine
CID 68280
1-Naphthalenamine, N-(dodecylphenyl)-
CID 116650
6,6'-Methylenebis(1,2-dihydro-2,2,4-trimethylquinoline)
CID 99342
(Phenanthren-9-yl)-phenyl-amine
CID 9943327
1,1'-Dinaphthylamine
CID 224480
Spirit Blue
CID 16534
N-(4-Biphenylyl)-2-naphthylamine
CID 236881
1,4-Benzenediamine, N-(2-methylphenyl)-N'-phenyl-
CID 3015360

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline?
The IUPAC name of 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline (CID 90370372) is 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline.
What is the SMILES notation for 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline?
The canonical SMILES for 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline is c1ccc(-c2cccc(-c3ccccc3Nc3ccccc3-c3ccccc3)c2)cc1.
What is the InChIKey of 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline?
The InChIKey is WHUQJUNPTMRNGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23N/c1-3-12-23(13-4-1)25-16-11-17-26(22-25)28-19-8-10-21-30(28)31-29-20-9-7-18-27(29)24-14-5-2-6-15-24/h1-22,31H.
What are the key properties of 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline?
2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline has a molecular weight of 397.52 g/mol, XLogP of 8.43, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[2-(3-phenylphenyl)phenyl]aniline is sourced from PubChem (CID 90370372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).