N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide

C12H15NO3 — CID 10704205

IUPACN-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide
SMILESCC(C)(C)ONC(=O)C(=O)c1ccccc1
InChIInChI=1S/C12H15NO3/c1-12(2,3)16-13-11(15)10(14)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,13,15)
InChIKeyMNDYBRBKSXADAD-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.72
Rot. Bonds3

About N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide

N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide (PubChem CID 10704205) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide.

Molecular Properties

Compound NameN-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide
PubChem CID10704205
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC NameN-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide
SMILESCC(C)(C)ONC(=O)C(=O)c1ccccc1
InChIInChI=1S/C12H15NO3/c1-12(2,3)16-13-11(15)10(14)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,13,15)
InChIKeyMNDYBRBKSXADAD-UHFFFAOYSA-N
XLogP1.72
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Cathinone
CID 62258
Benzohydroxamic acid
CID 10313
Ethanone, 2-amino-1-phenyl-, hydrochloride (1:1)
CID 2723597
2-Methylbenzamide
CID 10704
N-hydroxy-4-methylbenzamide
CID 426839
Cathinone hydrochloride
CID 11956149
(-)-alpha-Amino-propiophenone
CID 107786
Phenacylamine
CID 11952
N-hydroxy-2-phenylacetamide
CID 220184
2-Amino-1-phenylpropan-1-one;hydrochloride
CID 204630
Potassium benzohydroxamate
CID 3808331
Terephthalyldihydroxamic acid
CID 88356

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide?
The IUPAC name of N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide (CID 10704205) is N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide.
What is the SMILES notation for N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide?
The canonical SMILES for N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide is CC(C)(C)ONC(=O)C(=O)c1ccccc1.
What is the InChIKey of N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide?
The InChIKey is MNDYBRBKSXADAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-12(2,3)16-13-11(15)10(14)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,13,15).
What are the key properties of N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide?
N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide has a molecular weight of 221.26 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpropan-2-yl)oxy]-2-oxo-2-phenylacetamide is sourced from PubChem (CID 10704205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).