4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline

C20H18N2 — CID 139434275

IUPAC4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline
SMILESC=Cc1ccc(-c2cc(N)ccc2-c2ccc(N)cc2)cc1
InChIInChI=1S/C20H18N2/c1-2-14-3-5-16(6-4-14)20-13-18(22)11-12-19(20)15-7-9-17(21)10-8-15/h2-13H,1,21-22H2
InChIKeyJIVXBMFRLUWGIP-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.83
Rot. Bonds3

About 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline

4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline (PubChem CID 139434275) has the molecular formula C20H18N2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline.

Molecular Properties

Compound Name4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline
PubChem CID139434275
Molecular FormulaC20H18N2
Molecular Weight286.38 g/mol
Exact Mass286.15
IUPAC Name4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline
SMILESC=Cc1ccc(-c2cc(N)ccc2-c2ccc(N)cc2)cc1
InChIInChI=1S/C20H18N2/c1-2-14-3-5-16(6-4-14)20-13-18(22)11-12-19(20)15-7-9-17(21)10-8-15/h2-13H,1,21-22H2
InChIKeyJIVXBMFRLUWGIP-UHFFFAOYSA-N
XLogP4.83
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(4-ethenyl-2-fluorophenyl)aniline
CID 174631918
4-ethenylaniline;hydroiodide
CID 175384899
4-[3,4-bis(4-aminophenyl)phenyl]aniline
CID 101079504
5-amino-2-[(4-ethenylphenyl)methyl]isoindole-1,3-dione
CID 139686525
4-[4-(4-aminophenyl)phenyl]-3-(3-phenylphenyl)aniline
CID 150238905
4-ethenylaniline;prop-2-enenitrile
CID 158730868
1,3,5,7-tetrakis(4-ethenylphenyl)naphthalene
CID 140790330
N-[5-amino-2-(4-aminophenyl)phenyl]-N-oxidohydroxylamine
CID 163176393
3-(4-fluorophenyl)-4-(4-methylphenyl)aniline
CID 157225237
3-(4-bromophenyl)-4-phenylaniline
CID 142474025
3-[2,4-diamino-6-(4-ethenylphenyl)phenyl]propane-1,2-diol
CID 154245812
4-ethenylbenzene-1,2-diamine
CID 18400401

Frequently Asked Questions

What is the IUPAC name of 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline?
The IUPAC name of 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline (CID 139434275) is 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline.
What is the SMILES notation for 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline?
The canonical SMILES for 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline is C=Cc1ccc(-c2cc(N)ccc2-c2ccc(N)cc2)cc1.
What is the InChIKey of 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline?
The InChIKey is JIVXBMFRLUWGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2/c1-2-14-3-5-16(6-4-14)20-13-18(22)11-12-19(20)15-7-9-17(21)10-8-15/h2-13H,1,21-22H2.
What are the key properties of 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline?
4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline has a molecular weight of 286.38 g/mol, XLogP of 4.83, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-aminophenyl)-3-(4-ethenylphenyl)aniline is sourced from PubChem (CID 139434275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).