2-[2-(hydroxyiminomethyl)phenoxy]acetamide

C9H10N2O3 — CID 57365599

IUPAC2-[2-(hydroxyiminomethyl)phenoxy]acetamide
SMILESNC(=O)COc1ccccc1C=NO
InChIInChI=1S/C9H10N2O3/c10-9(12)6-14-8-4-2-1-3-7(8)5-11-13/h1-5,13H,6H2,(H2,10,12)
InChIKeyMTGJRXQOGAEBPJ-UHFFFAOYSA-N
MW194.19 g/mol
LogP0.36
Rot. Bonds4

About 2-[2-(hydroxyiminomethyl)phenoxy]acetamide

2-[2-(hydroxyiminomethyl)phenoxy]acetamide (PubChem CID 57365599) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is 2-[2-(hydroxyiminomethyl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-(hydroxyiminomethyl)phenoxy]acetamide
PubChem CID57365599
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name2-[2-(hydroxyiminomethyl)phenoxy]acetamide
SMILESNC(=O)COc1ccccc1C=NO
InChIInChI=1S/C9H10N2O3/c10-9(12)6-14-8-4-2-1-3-7(8)5-11-13/h1-5,13H,6H2,(H2,10,12)
InChIKeyMTGJRXQOGAEBPJ-UHFFFAOYSA-N
XLogP0.36
TPSA84.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2-prop-2-enoxyphenyl)methylidene]hydroxylamine
CID 659181
2-(2-hydroxyphenoxy)acetamide
CID 786426
N-[(E)-[2-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-3-methoxybenzamide
CID 126273932
(NZ)-N-[(2-heptoxyphenyl)methylidene]hydroxylamine
CID 112720770
N'-[(Z)-[2-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-N-[(1R)-1-phenylethyl]oxamide
CID 8990162
2-[5-bromo-4-[(E)-hydroxyiminomethyl]-2-methoxyphenoxy]acetamide
CID 19617611
2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]acetamide
CID 24699457
methyl (E)-3-(4-chlorophenyl)-2-[[2-[(E)-hydroxyiminomethyl]phenoxy]methyl]prop-2-enoate
CID 139082024
2-[2-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetamide
CID 1223156
(NZ)-N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine
CID 5408745
N-[[2-[2-(2-propan-2-ylphenoxy)ethoxy]phenyl]methylidene]hydroxylamine
CID 20991908
N-[[2-[2-(4-phenylphenoxy)ethoxy]phenyl]methylidene]hydroxylamine
CID 22681760

Frequently Asked Questions

What is the IUPAC name of 2-[2-(hydroxyiminomethyl)phenoxy]acetamide?
The IUPAC name of 2-[2-(hydroxyiminomethyl)phenoxy]acetamide (CID 57365599) is 2-[2-(hydroxyiminomethyl)phenoxy]acetamide.
What is the SMILES notation for 2-[2-(hydroxyiminomethyl)phenoxy]acetamide?
The canonical SMILES for 2-[2-(hydroxyiminomethyl)phenoxy]acetamide is NC(=O)COc1ccccc1C=NO.
What is the InChIKey of 2-[2-(hydroxyiminomethyl)phenoxy]acetamide?
The InChIKey is MTGJRXQOGAEBPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c10-9(12)6-14-8-4-2-1-3-7(8)5-11-13/h1-5,13H,6H2,(H2,10,12).
What are the key properties of 2-[2-(hydroxyiminomethyl)phenoxy]acetamide?
2-[2-(hydroxyiminomethyl)phenoxy]acetamide has a molecular weight of 194.19 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(hydroxyiminomethyl)phenoxy]acetamide is sourced from PubChem (CID 57365599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).