2-(2-phenylethylamino)ethanol

C10H15NO — CID 17826

IUPAC2-(2-phenylethylamino)ethanol
SMILESOCCNCCc1ccccc1
InChIInChI=1S/C10H15NO/c12-9-8-11-7-6-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2
InChIKeyWPOHVHKEDGUEPZ-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.81
Rot. Bonds5

About 2-(2-phenylethylamino)ethanol

2-(2-phenylethylamino)ethanol (PubChem CID 17826) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-(2-phenylethylamino)ethanol.

Molecular Properties

Compound Name2-(2-phenylethylamino)ethanol
PubChem CID17826
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-(2-phenylethylamino)ethanol
SMILESOCCNCCc1ccccc1
InChIInChI=1S/C10H15NO/c12-9-8-11-7-6-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2
InChIKeyWPOHVHKEDGUEPZ-UHFFFAOYSA-N
XLogP0.81
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylethylamino)ethanol?
The IUPAC name of 2-(2-phenylethylamino)ethanol (CID 17826) is 2-(2-phenylethylamino)ethanol.
What is the SMILES notation for 2-(2-phenylethylamino)ethanol?
The canonical SMILES for 2-(2-phenylethylamino)ethanol is OCCNCCc1ccccc1.
What is the InChIKey of 2-(2-phenylethylamino)ethanol?
The InChIKey is WPOHVHKEDGUEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c12-9-8-11-7-6-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2.
What are the key properties of 2-(2-phenylethylamino)ethanol?
2-(2-phenylethylamino)ethanol has a molecular weight of 165.24 g/mol, XLogP of 0.81, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylethylamino)ethanol is sourced from PubChem (CID 17826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).