2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline

C26H22N2 — CID 162512010

IUPAC2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline
SMILESNc1ccccc1C(=C(c1ccccc1)c1ccccc1N)c1ccccc1
InChIInChI=1S/C26H22N2/c27-23-17-9-7-15-21(23)25(19-11-3-1-4-12-19)26(20-13-5-2-6-14-20)22-16-8-10-18-24(22)28/h1-18H,27-28H2
InChIKeyFUSWZJAYBRVBSJ-UHFFFAOYSA-N
MW362.48 g/mol
LogP5.86
Rot. Bonds4

About 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline

2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline (PubChem CID 162512010) has the molecular formula C26H22N2 and a molecular weight of 362.48 g/mol. Its IUPAC name is 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline.

Molecular Properties

Compound Name2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline
PubChem CID162512010
Molecular FormulaC26H22N2
Molecular Weight362.48 g/mol
Exact Mass362.18
IUPAC Name2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline
SMILESNc1ccccc1C(=C(c1ccccc1)c1ccccc1N)c1ccccc1
InChIInChI=1S/C26H22N2/c27-23-17-9-7-15-21(23)25(19-11-3-1-4-12-19)26(20-13-5-2-6-14-20)22-16-8-10-18-24(22)28/h1-18H,27-28H2
InChIKeyFUSWZJAYBRVBSJ-UHFFFAOYSA-N
XLogP5.86
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.48
LogP ≤ 55.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline?
The IUPAC name of 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline (CID 162512010) is 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline.
What is the SMILES notation for 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline?
The canonical SMILES for 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline is Nc1ccccc1C(=C(c1ccccc1)c1ccccc1N)c1ccccc1.
What is the InChIKey of 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline?
The InChIKey is FUSWZJAYBRVBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2/c27-23-17-9-7-15-21(23)25(19-11-3-1-4-12-19)26(20-13-5-2-6-14-20)22-16-8-10-18-24(22)28/h1-18H,27-28H2.
What are the key properties of 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline?
2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline has a molecular weight of 362.48 g/mol, XLogP of 5.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminophenyl)-1,2-diphenylethenyl]aniline is sourced from PubChem (CID 162512010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).