N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide

C12H16N2O2 — CID 2849070

IUPACN-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide
SMILESCC(C)=NOCC(=O)Nc1ccccc1C
InChIInChI=1S/C12H16N2O2/c1-9(2)14-16-8-12(15)13-11-7-5-4-6-10(11)3/h4-7H,8H2,1-3H3,(H,13,15)
InChIKeyBGXAUMORJIAUHJ-UHFFFAOYSA-N
MW220.27 g/mol
LogP2.35
Rot. Bonds4

About N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide

N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide (PubChem CID 2849070) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide
PubChem CID2849070
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide
SMILESCC(C)=NOCC(=O)Nc1ccccc1C
InChIInChI=1S/C12H16N2O2/c1-9(2)14-16-8-12(15)13-11-7-5-4-6-10(11)3/h4-7H,8H2,1-3H3,(H,13,15)
InChIKeyBGXAUMORJIAUHJ-UHFFFAOYSA-N
XLogP2.35
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 52.35
H-Bond Donors ≤ 51
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-acetyl-o-toluidine
CID 8443
O-Ethylacetanilide
CID 36332
Acetamide, N-(2-ethyl-6-methylphenyl)-2-hydroxy-
CID 178925
N-(2,6-dimethylphenyl)-2-methoxyacetamide
CID 10878014
2',6'-Glycoloxylidide
CID 14480057
(2E)-2-(hydroxyimino)-N-(2-methylphenyl)acetamide
CID 6871299
2-Hydroxy-2',6'-diethylacetanilide
CID 162686
[N-(2-methylphenyl)carbamoyl]methyl acetate
CID 716417
N-Hydroxy-N''-(2-methylphenyl)octanediamide
CID 46884055
2-[[amino(phenyl)methylidene]amino]oxy-N-(2-methylphenyl)acetamide
CID 4842829
N-(2-cyanophenyl)-2-methoxyacetamide
CID 1224046
Ethyl [(2-methylphenyl)amino](oxo)acetate
CID 366755

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide?
The IUPAC name of N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide (CID 2849070) is N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide.
What is the SMILES notation for N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide?
The canonical SMILES for N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide is CC(C)=NOCC(=O)Nc1ccccc1C.
What is the InChIKey of N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide?
The InChIKey is BGXAUMORJIAUHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-9(2)14-16-8-12(15)13-11-7-5-4-6-10(11)3/h4-7H,8H2,1-3H3,(H,13,15).
What are the key properties of N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide?
N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide has a molecular weight of 220.27 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-2-(propan-2-ylideneamino)oxyacetamide is sourced from PubChem (CID 2849070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).