2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide

C12H16N2O2 — CID 112672575

IUPAC2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide
SMILESNC(=O)CONC(c1ccccc1)C1CC1
InChIInChI=1S/C12H16N2O2/c13-11(15)8-16-14-12(10-6-7-10)9-4-2-1-3-5-9/h1-5,10,12,14H,6-8H2,(H2,13,15)
InChIKeySOTLFBXYEZVQBY-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.14
Rot. Bonds6

About 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide

2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide (PubChem CID 112672575) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide.

Molecular Properties

Compound Name2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide
PubChem CID112672575
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide
SMILESNC(=O)CONC(c1ccccc1)C1CC1
InChIInChI=1S/C12H16N2O2/c13-11(15)8-16-14-12(10-6-7-10)9-4-2-1-3-5-9/h1-5,10,12,14H,6-8H2,(H2,13,15)
InChIKeySOTLFBXYEZVQBY-UHFFFAOYSA-N
XLogP1.14
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.14
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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Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide?
The IUPAC name of 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide (CID 112672575) is 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide.
What is the SMILES notation for 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide?
The canonical SMILES for 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide is NC(=O)CONC(c1ccccc1)C1CC1.
What is the InChIKey of 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide?
The InChIKey is SOTLFBXYEZVQBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c13-11(15)8-16-14-12(10-6-7-10)9-4-2-1-3-5-9/h1-5,10,12,14H,6-8H2,(H2,13,15).
What are the key properties of 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide?
2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide has a molecular weight of 220.27 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide is sourced from PubChem (CID 112672575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).