2-amino-1-(4-ethylphenyl)ethanol

C10H15NO — CID 16768294

IUPAC2-amino-1-(4-ethylphenyl)ethanol
SMILESCCc1ccc(C(O)CN)cc1
InChIInChI=1S/C10H15NO/c1-2-8-3-5-9(6-4-8)10(12)7-11/h3-6,10,12H,2,7,11H2,1H3
InChIKeyXIZKPKJTDGAEGJ-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.24
Rot. Bonds3

About 2-amino-1-(4-ethylphenyl)ethanol

2-amino-1-(4-ethylphenyl)ethanol (PubChem CID 16768294) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-amino-1-(4-ethylphenyl)ethanol.

Molecular Properties

Compound Name2-amino-1-(4-ethylphenyl)ethanol
PubChem CID16768294
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-amino-1-(4-ethylphenyl)ethanol
SMILESCCc1ccc(C(O)CN)cc1
InChIInChI=1S/C10H15NO/c1-2-8-3-5-9(6-4-8)10(12)7-11/h3-6,10,12H,2,7,11H2,1H3
InChIKeyXIZKPKJTDGAEGJ-UHFFFAOYSA-N
XLogP1.24
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-ethylphenyl)ethanol?
The IUPAC name of 2-amino-1-(4-ethylphenyl)ethanol (CID 16768294) is 2-amino-1-(4-ethylphenyl)ethanol.
What is the SMILES notation for 2-amino-1-(4-ethylphenyl)ethanol?
The canonical SMILES for 2-amino-1-(4-ethylphenyl)ethanol is CCc1ccc(C(O)CN)cc1.
What is the InChIKey of 2-amino-1-(4-ethylphenyl)ethanol?
The InChIKey is XIZKPKJTDGAEGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-2-8-3-5-9(6-4-8)10(12)7-11/h3-6,10,12H,2,7,11H2,1H3.
What are the key properties of 2-amino-1-(4-ethylphenyl)ethanol?
2-amino-1-(4-ethylphenyl)ethanol has a molecular weight of 165.24 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-ethylphenyl)ethanol is sourced from PubChem (CID 16768294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).