2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide

C10H10F2N2O3 — CID 18292189

IUPAC2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide
SMILESNC(=O)CO/N=C/c1ccccc1OC(F)F
InChIInChI=1S/C10H10F2N2O3/c11-10(12)17-8-4-2-1-3-7(8)5-14-16-6-9(13)15/h1-5,10H,6H2,(H2,13,15)/b14-5+
InChIKeyJWGTUUNPNUBROR-LHHJGKSTSA-N
MW244.20 g/mol
LogP1.12
Rot. Bonds6

About 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide

2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide (PubChem CID 18292189) has the molecular formula C10H10F2N2O3 and a molecular weight of 244.20 g/mol. Its IUPAC name is 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide.

Molecular Properties

Compound Name2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide
PubChem CID18292189
Molecular FormulaC10H10F2N2O3
Molecular Weight244.20 g/mol
Exact Mass244.07
IUPAC Name2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide
SMILESNC(=O)CO/N=C/c1ccccc1OC(F)F
InChIInChI=1S/C10H10F2N2O3/c11-10(12)17-8-4-2-1-3-7(8)5-14-16-6-9(13)15/h1-5,10H,6H2,(H2,13,15)/b14-5+
InChIKeyJWGTUUNPNUBROR-LHHJGKSTSA-N
XLogP1.12
TPSA73.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.20
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(1S)-1-phenylethyl]acetamide
CID 7644363
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(3,4-dimethoxyphenyl)acetamide
CID 7644378
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(2-propan-2-ylphenyl)acetamide
CID 7644360
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(2-methoxyphenyl)methyl]acetamide
CID 7644287
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 7644461
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(3-methylphenyl)acetamide
CID 7644292
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(2,4-dimethylphenyl)acetamide
CID 7644362
2-[[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(2-methylcyclohexyl)acetamide
CID 5171892
N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide
CID 78766744
2-[(E)-[4-(difluoromethoxy)-3-methoxyphenyl]methylideneamino]oxyacetamide
CID 16545202
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(3-methylsulfonylphenyl)acetamide
CID 9353732
N-(5-chloro-2-methoxyphenyl)-2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide
CID 7644389

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide?
The IUPAC name of 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide (CID 18292189) is 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide.
What is the SMILES notation for 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide?
The canonical SMILES for 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide is NC(=O)CO/N=C/c1ccccc1OC(F)F.
What is the InChIKey of 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide?
The InChIKey is JWGTUUNPNUBROR-LHHJGKSTSA-N. The full InChI is InChI=1S/C10H10F2N2O3/c11-10(12)17-8-4-2-1-3-7(8)5-14-16-6-9(13)15/h1-5,10H,6H2,(H2,13,15)/b14-5+.
What are the key properties of 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide?
2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide has a molecular weight of 244.20 g/mol, XLogP of 1.12, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide is sourced from PubChem (CID 18292189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).