1-[(Z)-2-amino-2-phenylethenoxy]ethenol

C10H11NO2 — CID 89011182

IUPAC1-[(Z)-2-amino-2-phenylethenoxy]ethenol
SMILESC=C(O)O/C=C(\N)c1ccccc1
InChIInChI=1S/C10H11NO2/c1-8(12)13-7-10(11)9-5-3-2-4-6-9/h2-7,12H,1,11H2/b10-7-
InChIKeyLNHJYGSTMZLCSV-YFHOEESVSA-N
MW177.20 g/mol
LogP1.99
Rot. Bonds3

About 1-[(Z)-2-amino-2-phenylethenoxy]ethenol

1-[(Z)-2-amino-2-phenylethenoxy]ethenol (PubChem CID 89011182) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 1-[(Z)-2-amino-2-phenylethenoxy]ethenol.

Molecular Properties

Compound Name1-[(Z)-2-amino-2-phenylethenoxy]ethenol
PubChem CID89011182
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name1-[(Z)-2-amino-2-phenylethenoxy]ethenol
SMILESC=C(O)O/C=C(\N)c1ccccc1
InChIInChI=1S/C10H11NO2/c1-8(12)13-7-10(11)9-5-3-2-4-6-9/h2-7,12H,1,11H2/b10-7-
InChIKeyLNHJYGSTMZLCSV-YFHOEESVSA-N
XLogP1.99
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-2-amino-2-phenylethenoxy]ethenol?
The IUPAC name of 1-[(Z)-2-amino-2-phenylethenoxy]ethenol (CID 89011182) is 1-[(Z)-2-amino-2-phenylethenoxy]ethenol.
What is the SMILES notation for 1-[(Z)-2-amino-2-phenylethenoxy]ethenol?
The canonical SMILES for 1-[(Z)-2-amino-2-phenylethenoxy]ethenol is C=C(O)O/C=C(\N)c1ccccc1.
What is the InChIKey of 1-[(Z)-2-amino-2-phenylethenoxy]ethenol?
The InChIKey is LNHJYGSTMZLCSV-YFHOEESVSA-N. The full InChI is InChI=1S/C10H11NO2/c1-8(12)13-7-10(11)9-5-3-2-4-6-9/h2-7,12H,1,11H2/b10-7-.
What are the key properties of 1-[(Z)-2-amino-2-phenylethenoxy]ethenol?
1-[(Z)-2-amino-2-phenylethenoxy]ethenol has a molecular weight of 177.20 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-2-amino-2-phenylethenoxy]ethenol is sourced from PubChem (CID 89011182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).