2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide

C10H9F3N2O2 — CID 71966857

IUPAC2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
SMILESO=C(CO)NN=Cc1ccccc1C(F)(F)F
InChIInChI=1S/C10H9F3N2O2/c11-10(12,13)8-4-2-1-3-7(8)5-14-15-9(17)6-16/h1-5,16H,6H2,(H,15,17)
InChIKeyAHSPHOMHZNGGOK-UHFFFAOYSA-N
MW246.19 g/mol
LogP1.15
Rot. Bonds3

About 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide

2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide (PubChem CID 71966857) has the molecular formula C10H9F3N2O2 and a molecular weight of 246.19 g/mol. Its IUPAC name is 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide.

Molecular Properties

Compound Name2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
PubChem CID71966857
Molecular FormulaC10H9F3N2O2
Molecular Weight246.19 g/mol
Exact Mass246.06
IUPAC Name2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
SMILESO=C(CO)NN=Cc1ccccc1C(F)(F)F
InChIInChI=1S/C10H9F3N2O2/c11-10(12,13)8-4-2-1-3-7(8)5-14-15-9(17)6-16/h1-5,16H,6H2,(H,15,17)
InChIKeyAHSPHOMHZNGGOK-UHFFFAOYSA-N
XLogP1.15
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.19
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

N-[[2-(trifluoromethyl)phenyl]methylideneamino]decanamide
CID 5075472
N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]octadecanamide
CID 45054433
2-(4-methoxyphenyl)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 6258756
2-(1-methylpyrrol-2-yl)-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 6900064
N-cyclohexyl-N'-[[2-(trifluoromethyl)phenyl]methylideneamino]propanediamide
CID 3734447
2-(4-chlorophenoxy)-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 6899394
2-thiomorpholin-4-yl-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 5338380
2-(4-tert-butylphenoxy)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 7750374
2-hydroxy-2,2-diphenyl-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 3297687
2-(4-benzylpiperazin-1-yl)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 6146827
2-[(3S)-1,1-dioxothiolan-3-yl]-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 8866124
2-(2,4-dichlorophenoxy)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
CID 6153860

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide?
The IUPAC name of 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide (CID 71966857) is 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide.
What is the SMILES notation for 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide?
The canonical SMILES for 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide is O=C(CO)NN=Cc1ccccc1C(F)(F)F.
What is the InChIKey of 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide?
The InChIKey is AHSPHOMHZNGGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2O2/c11-10(12,13)8-4-2-1-3-7(8)5-14-15-9(17)6-16/h1-5,16H,6H2,(H,15,17).
What are the key properties of 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide?
2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide has a molecular weight of 246.19 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[[2-(trifluoromethyl)phenyl]methylideneamino]acetamide is sourced from PubChem (CID 71966857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).