N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide

C14H20N2O3 — CID 82724139

IUPACN-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide
SMILESCC(NC(=O)c1ccccc1)C(=O)NOC(C)(C)C
InChIInChI=1S/C14H20N2O3/c1-10(12(17)16-19-14(2,3)4)15-13(18)11-8-6-5-7-9-11/h5-10H,1-4H3,(H,15,18)(H,16,17)
InChIKeyWJVJZZGEKGHVSL-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.65
Rot. Bonds4

About N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide

N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide (PubChem CID 82724139) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide
PubChem CID82724139
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide
SMILESCC(NC(=O)c1ccccc1)C(=O)NOC(C)(C)C
InChIInChI=1S/C14H20N2O3/c1-10(12(17)16-19-14(2,3)4)15-13(18)11-8-6-5-7-9-11/h5-10H,1-4H3,(H,15,18)(H,16,17)
InChIKeyWJVJZZGEKGHVSL-UHFFFAOYSA-N
XLogP1.65
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl (2R)-2-benzamidopropanoate
CID 81004223
N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]benzamide
CID 673653
methyl (2S)-2-benzamidopropanoate
CID 6364617
N-[(2S)-1-(methylamino)-1-oxopropan-2-yl]benzamide
CID 68732786
N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]benzamide
CID 42909871
N-[(2S)-1-[2-[[(2S)-2-benzamidopropanoyl]amino]ethylamino]-1-oxopropan-2-yl]benzamide
CID 71491153
N-[(2S)-1-amino-1-oxopropan-2-yl]benzamide
CID 12859609
N-[(2S)-1-[[(2R)-butan-2-yl]amino]-1-oxopropan-2-yl]benzamide
CID 94102098
N-[(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxopropan-2-yl]benzamide
CID 94102099
N-[1-(1,3-dihydroxypropan-2-ylamino)-1-oxopropan-2-yl]benzamide
CID 65315325
N-[(2S)-1-[3-[[(2S)-2-benzamidopropanoyl]amino]propylamino]-1-oxopropan-2-yl]benzamide
CID 71491154
N-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]benzamide
CID 24639209

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide?
The IUPAC name of N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide (CID 82724139) is N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide.
What is the SMILES notation for N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide?
The canonical SMILES for N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide is CC(NC(=O)c1ccccc1)C(=O)NOC(C)(C)C.
What is the InChIKey of N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide?
The InChIKey is WJVJZZGEKGHVSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10(12(17)16-19-14(2,3)4)15-13(18)11-8-6-5-7-9-11/h5-10H,1-4H3,(H,15,18)(H,16,17).
What are the key properties of N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide?
N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide has a molecular weight of 264.32 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2-methylpropan-2-yl)oxyamino]-1-oxopropan-2-yl]benzamide is sourced from PubChem (CID 82724139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).