(E)-1-(methoxyamino)-2-phenylethenol

C9H11NO2 — CID 10012253

IUPAC(E)-1-(methoxyamino)-2-phenylethenol
SMILESCON/C(O)=C\c1ccccc1
InChIInChI=1S/C9H11NO2/c1-12-10-9(11)7-8-5-3-2-4-6-8/h2-7,10-11H,1H3/b9-7+
InChIKeyKNRVTTIJUXLYIA-VQHVLOKHSA-N
MW165.19 g/mol
LogP1.69
Rot. Bonds3

About (E)-1-(methoxyamino)-2-phenylethenol

(E)-1-(methoxyamino)-2-phenylethenol (PubChem CID 10012253) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is (E)-1-(methoxyamino)-2-phenylethenol.

Molecular Properties

Compound Name(E)-1-(methoxyamino)-2-phenylethenol
PubChem CID10012253
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC Name(E)-1-(methoxyamino)-2-phenylethenol
SMILESCON/C(O)=C\c1ccccc1
InChIInChI=1S/C9H11NO2/c1-12-10-9(11)7-8-5-3-2-4-6-8/h2-7,10-11H,1H3/b9-7+
InChIKeyKNRVTTIJUXLYIA-VQHVLOKHSA-N
XLogP1.69
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(Z)-1-methoxy-2-phenylethenethiol
CID 12543362
[(Z)-1-methoxy-2-phenylethenyl]-trimethylgermane
CID 134971042
2-methoxy-3-phenylprop-2-enoic acid
CID 7021154
europium;tris(2-methoxy-3-phenylprop-2-enoic acid)
CID 169448208
CID 159805914
CID 159805914
(Z)-1-(butylamino)-2-phenylethenol
CID 134892949
(Z)-3-methoxy-4-phenylbut-3-en-1-ol
CID 134985756
(2-butoxy-2-methoxyethenyl)benzene
CID 159522831
dimethyl 2-[(E)-3-oxo-1-phenylprop-1-en-2-yl]propanedioate
CID 101430340
2-benzylidene-3-methoxycarbonyl-4-phenylbut-3-enoic acid
CID 4736767
N-(1-phenylprop-1-en-2-yl)hydroxylamine
CID 174837746
2-methoxyethyl 2-methoxy-3-phenylprop-2-enoate
CID 150649669

Frequently Asked Questions

What is the IUPAC name of (E)-1-(methoxyamino)-2-phenylethenol?
The IUPAC name of (E)-1-(methoxyamino)-2-phenylethenol (CID 10012253) is (E)-1-(methoxyamino)-2-phenylethenol.
What is the SMILES notation for (E)-1-(methoxyamino)-2-phenylethenol?
The canonical SMILES for (E)-1-(methoxyamino)-2-phenylethenol is CON/C(O)=C\c1ccccc1.
What is the InChIKey of (E)-1-(methoxyamino)-2-phenylethenol?
The InChIKey is KNRVTTIJUXLYIA-VQHVLOKHSA-N. The full InChI is InChI=1S/C9H11NO2/c1-12-10-9(11)7-8-5-3-2-4-6-8/h2-7,10-11H,1H3/b9-7+.
What are the key properties of (E)-1-(methoxyamino)-2-phenylethenol?
(E)-1-(methoxyamino)-2-phenylethenol has a molecular weight of 165.19 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(methoxyamino)-2-phenylethenol is sourced from PubChem (CID 10012253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).