2-[(2-methylphenyl)methylamino]oxyacetamide

C10H14N2O2 — CID 112672645

IUPAC2-[(2-methylphenyl)methylamino]oxyacetamide
SMILESCc1ccccc1CNOCC(N)=O
InChIInChI=1S/C10H14N2O2/c1-8-4-2-3-5-9(8)6-12-14-7-10(11)13/h2-5,12H,6-7H2,1H3,(H2,11,13)
InChIKeyWZFNYSOZNSGVGI-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.50
Rot. Bonds5

About 2-[(2-methylphenyl)methylamino]oxyacetamide

2-[(2-methylphenyl)methylamino]oxyacetamide (PubChem CID 112672645) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-[(2-methylphenyl)methylamino]oxyacetamide.

Molecular Properties

Compound Name2-[(2-methylphenyl)methylamino]oxyacetamide
PubChem CID112672645
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-[(2-methylphenyl)methylamino]oxyacetamide
SMILESCc1ccccc1CNOCC(N)=O
InChIInChI=1S/C10H14N2O2/c1-8-4-2-3-5-9(8)6-12-14-7-10(11)13/h2-5,12H,6-7H2,1H3,(H2,11,13)
InChIKeyWZFNYSOZNSGVGI-UHFFFAOYSA-N
XLogP0.50
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[(2-methylphenyl)methylamino]oxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylphenyl)methylamino]oxyacetamide?
The IUPAC name of 2-[(2-methylphenyl)methylamino]oxyacetamide (CID 112672645) is 2-[(2-methylphenyl)methylamino]oxyacetamide.
What is the SMILES notation for 2-[(2-methylphenyl)methylamino]oxyacetamide?
The canonical SMILES for 2-[(2-methylphenyl)methylamino]oxyacetamide is Cc1ccccc1CNOCC(N)=O.
What is the InChIKey of 2-[(2-methylphenyl)methylamino]oxyacetamide?
The InChIKey is WZFNYSOZNSGVGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-8-4-2-3-5-9(8)6-12-14-7-10(11)13/h2-5,12H,6-7H2,1H3,(H2,11,13).
What are the key properties of 2-[(2-methylphenyl)methylamino]oxyacetamide?
2-[(2-methylphenyl)methylamino]oxyacetamide has a molecular weight of 194.23 g/mol, XLogP of 0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylphenyl)methylamino]oxyacetamide is sourced from PubChem (CID 112672645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).