2-(2-amino-5-ethenylphenyl)ethanol

C10H13NO — CID 91295799

IUPAC2-(2-amino-5-ethenylphenyl)ethanol
SMILESC=Cc1ccc(N)c(CCO)c1
InChIInChI=1S/C10H13NO/c1-2-8-3-4-10(11)9(7-8)5-6-12/h2-4,7,12H,1,5-6,11H2
InChIKeyLJHSQWOLCACJEA-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.45
Rot. Bonds3

About 2-(2-amino-5-ethenylphenyl)ethanol

2-(2-amino-5-ethenylphenyl)ethanol (PubChem CID 91295799) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 2-(2-amino-5-ethenylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-amino-5-ethenylphenyl)ethanol
PubChem CID91295799
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name2-(2-amino-5-ethenylphenyl)ethanol
SMILESC=Cc1ccc(N)c(CCO)c1
InChIInChI=1S/C10H13NO/c1-2-8-3-4-10(11)9(7-8)5-6-12/h2-4,7,12H,1,5-6,11H2
InChIKeyLJHSQWOLCACJEA-UHFFFAOYSA-N
XLogP1.45
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.45
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 2-(2-amino-5-ethenylphenyl)ethanol?
The IUPAC name of 2-(2-amino-5-ethenylphenyl)ethanol (CID 91295799) is 2-(2-amino-5-ethenylphenyl)ethanol.
What is the SMILES notation for 2-(2-amino-5-ethenylphenyl)ethanol?
The canonical SMILES for 2-(2-amino-5-ethenylphenyl)ethanol is C=Cc1ccc(N)c(CCO)c1.
What is the InChIKey of 2-(2-amino-5-ethenylphenyl)ethanol?
The InChIKey is LJHSQWOLCACJEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-2-8-3-4-10(11)9(7-8)5-6-12/h2-4,7,12H,1,5-6,11H2.
What are the key properties of 2-(2-amino-5-ethenylphenyl)ethanol?
2-(2-amino-5-ethenylphenyl)ethanol has a molecular weight of 163.22 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-5-ethenylphenyl)ethanol is sourced from PubChem (CID 91295799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).