1-(2-aminophenyl)-1,2-diphenylethanol

C20H19NO — CID 2803358

IUPAC1-(2-aminophenyl)-1,2-diphenylethanol
SMILESNc1ccccc1C(O)(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C20H19NO/c21-19-14-8-7-13-18(19)20(22,17-11-5-2-6-12-17)15-16-9-3-1-4-10-16/h1-14,22H,15,21H2
InChIKeyLUPBXHUCHLZODP-UHFFFAOYSA-N
MW289.38 g/mol
LogP3.75
Rot. Bonds4

About 1-(2-aminophenyl)-1,2-diphenylethanol

1-(2-aminophenyl)-1,2-diphenylethanol (PubChem CID 2803358) has the molecular formula C20H19NO and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-(2-aminophenyl)-1,2-diphenylethanol.

Molecular Properties

Compound Name1-(2-aminophenyl)-1,2-diphenylethanol
PubChem CID2803358
Molecular FormulaC20H19NO
Molecular Weight289.38 g/mol
Exact Mass289.15
IUPAC Name1-(2-aminophenyl)-1,2-diphenylethanol
SMILESNc1ccccc1C(O)(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C20H19NO/c21-19-14-8-7-13-18(19)20(22,17-11-5-2-6-12-17)15-16-9-3-1-4-10-16/h1-14,22H,15,21H2
InChIKeyLUPBXHUCHLZODP-UHFFFAOYSA-N
XLogP3.75
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenyl)-1,2-diphenylethanol?
The IUPAC name of 1-(2-aminophenyl)-1,2-diphenylethanol (CID 2803358) is 1-(2-aminophenyl)-1,2-diphenylethanol.
What is the SMILES notation for 1-(2-aminophenyl)-1,2-diphenylethanol?
The canonical SMILES for 1-(2-aminophenyl)-1,2-diphenylethanol is Nc1ccccc1C(O)(Cc1ccccc1)c1ccccc1.
What is the InChIKey of 1-(2-aminophenyl)-1,2-diphenylethanol?
The InChIKey is LUPBXHUCHLZODP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c21-19-14-8-7-13-18(19)20(22,17-11-5-2-6-12-17)15-16-9-3-1-4-10-16/h1-14,22H,15,21H2.
What are the key properties of 1-(2-aminophenyl)-1,2-diphenylethanol?
1-(2-aminophenyl)-1,2-diphenylethanol has a molecular weight of 289.38 g/mol, XLogP of 3.75, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenyl)-1,2-diphenylethanol is sourced from PubChem (CID 2803358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).