N-(4-ethylphenyl)-3-phenylaniline

C20H19N — CID 142244163

IUPACN-(4-ethylphenyl)-3-phenylaniline
SMILESCCc1ccc(Nc2cccc(-c3ccccc3)c2)cc1
InChIInChI=1S/C20H19N/c1-2-16-11-13-19(14-12-16)21-20-10-6-9-18(15-20)17-7-4-3-5-8-17/h3-15,21H,2H2,1H3
InChIKeyZPQSDXLCWMNWSN-UHFFFAOYSA-N
MW273.38 g/mol
LogP5.66
Rot. Bonds4

About N-(4-ethylphenyl)-3-phenylaniline

N-(4-ethylphenyl)-3-phenylaniline (PubChem CID 142244163) has the molecular formula C20H19N and a molecular weight of 273.38 g/mol. Its IUPAC name is N-(4-ethylphenyl)-3-phenylaniline.

Molecular Properties

Compound NameN-(4-ethylphenyl)-3-phenylaniline
PubChem CID142244163
Molecular FormulaC20H19N
Molecular Weight273.38 g/mol
Exact Mass273.15
IUPAC NameN-(4-ethylphenyl)-3-phenylaniline
SMILESCCc1ccc(Nc2cccc(-c3ccccc3)c2)cc1
InChIInChI=1S/C20H19N/c1-2-16-11-13-19(14-12-16)21-20-10-6-9-18(15-20)17-7-4-3-5-8-17/h3-15,21H,2H2,1H3
InChIKeyZPQSDXLCWMNWSN-UHFFFAOYSA-N
XLogP5.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.38
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-phenyl-3-(4-phenylphenyl)aniline
CID 58389913
N-(3-fluorophenyl)-3-phenylaniline
CID 126702115
1-(4-ethylphenyl)-3,5-diphenylbenzene
CID 123998830
N-phenyl-3-pyridin-4-ylaniline
CID 118505949
1,1'-biphenyl;3-methyl-N-phenylaniline
CID 19838437
3-ethyl-N-(4-methylphenyl)aniline
CID 139833776
1-ethyl-3-phenylbenzene;propane
CID 145466525
ethane;1-ethyl-4-phenylbenzene;methane
CID 142852812
acetylene;1-ethyl-4-phenylbenzene
CID 175126841
N-[4-(4-anilinophenyl)phenyl]-3-methylaniline
CID 90221896
N,6-diphenylnaphthalen-2-amine
CID 67205043
4-(4-butylphenyl)-N-phenylaniline
CID 141426915

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-3-phenylaniline?
The IUPAC name of N-(4-ethylphenyl)-3-phenylaniline (CID 142244163) is N-(4-ethylphenyl)-3-phenylaniline.
What is the SMILES notation for N-(4-ethylphenyl)-3-phenylaniline?
The canonical SMILES for N-(4-ethylphenyl)-3-phenylaniline is CCc1ccc(Nc2cccc(-c3ccccc3)c2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-3-phenylaniline?
The InChIKey is ZPQSDXLCWMNWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N/c1-2-16-11-13-19(14-12-16)21-20-10-6-9-18(15-20)17-7-4-3-5-8-17/h3-15,21H,2H2,1H3.
What are the key properties of N-(4-ethylphenyl)-3-phenylaniline?
N-(4-ethylphenyl)-3-phenylaniline has a molecular weight of 273.38 g/mol, XLogP of 5.66, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-3-phenylaniline is sourced from PubChem (CID 142244163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).