N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide

C15H22N2O3 — CID 78766744

IUPACN-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide
SMILESCC(C)NC(=O)CO/N=C/c1ccccc1OC(C)C
InChIInChI=1S/C15H22N2O3/c1-11(2)17-15(18)10-19-16-9-13-7-5-6-8-14(13)20-12(3)4/h5-9,11-12H,10H2,1-4H3,(H,17,18)/b16-9+
InChIKeyMVJGBWODHVWSSK-CXUHLZMHSA-N
MW278.35 g/mol
LogP2.35
Rot. Bonds7

About N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide

N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide (PubChem CID 78766744) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide
PubChem CID78766744
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide
SMILESCC(C)NC(=O)CO/N=C/c1ccccc1OC(C)C
InChIInChI=1S/C15H22N2O3/c1-11(2)17-15(18)10-19-16-9-13-7-5-6-8-14(13)20-12(3)4/h5-9,11-12H,10H2,1-4H3,(H,17,18)/b16-9+
InChIKeyMVJGBWODHVWSSK-CXUHLZMHSA-N
XLogP2.35
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.35
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

1-(azepan-1-yl)-2-[(2-propan-2-yloxyphenyl)methylideneamino]oxyethanone
CID 78767129
N-(3-methylphenyl)-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide
CID 78767132
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(1S)-1-phenylethyl]acetamide
CID 7644363
N-[(2R)-butan-2-yl]-2-[(Z)-(2-methoxyphenyl)methylideneamino]oxyacetamide
CID 7664433
N-(3-methylsulfanylphenyl)-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide
CID 78767160
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 7644461
2-[(E)-[2-(difluoromethoxy)phenyl]methylideneamino]oxyacetamide
CID 18292189
N-methoxy-1-(2-propan-2-yloxyphenyl)methanimine
CID 73094502
N,N'-bis[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxamide
CID 5334919
2-[(Z)-[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(2-propan-2-ylphenyl)acetamide
CID 7644360
methyl 2-[[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxymethyl]furan-3-carboxylate
CID 78839600
2-[[2-(difluoromethoxy)phenyl]methylideneamino]oxy-N-(2-methylcyclohexyl)acetamide
CID 5171892

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide?
The IUPAC name of N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide (CID 78766744) is N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide.
What is the SMILES notation for N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide?
The canonical SMILES for N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide is CC(C)NC(=O)CO/N=C/c1ccccc1OC(C)C.
What is the InChIKey of N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide?
The InChIKey is MVJGBWODHVWSSK-CXUHLZMHSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-11(2)17-15(18)10-19-16-9-13-7-5-6-8-14(13)20-12(3)4/h5-9,11-12H,10H2,1-4H3,(H,17,18)/b16-9+.
What are the key properties of N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide?
N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide has a molecular weight of 278.35 g/mol, XLogP of 2.35, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-[(E)-(2-propan-2-yloxyphenyl)methylideneamino]oxyacetamide is sourced from PubChem (CID 78766744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).