2-[(2,4-dimethylphenyl)methylamino]oxyacetamide

C11H16N2O2 — CID 112672487

IUPAC2-[(2,4-dimethylphenyl)methylamino]oxyacetamide
SMILESCc1ccc(CNOCC(N)=O)c(C)c1
InChIInChI=1S/C11H16N2O2/c1-8-3-4-10(9(2)5-8)6-13-15-7-11(12)14/h3-5,13H,6-7H2,1-2H3,(H2,12,14)
InChIKeyCSGHDISYONGQIH-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.81
Rot. Bonds5

About 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide

2-[(2,4-dimethylphenyl)methylamino]oxyacetamide (PubChem CID 112672487) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide.

Molecular Properties

Compound Name2-[(2,4-dimethylphenyl)methylamino]oxyacetamide
PubChem CID112672487
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-[(2,4-dimethylphenyl)methylamino]oxyacetamide
SMILESCc1ccc(CNOCC(N)=O)c(C)c1
InChIInChI=1S/C11H16N2O2/c1-8-3-4-10(9(2)5-8)6-13-15-7-11(12)14/h3-5,13H,6-7H2,1-2H3,(H2,12,14)
InChIKeyCSGHDISYONGQIH-UHFFFAOYSA-N
XLogP0.81
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.81
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'}

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Related Compounds

2-[(2,5-dimethylphenyl)methylamino]oxyacetamide
CID 112672460
2-[(2-hydroxy-5-methylphenyl)methylamino]oxyacetamide
CID 112673254
2-[(2-methylphenyl)methylamino]oxyacetamide
CID 112672645
3-[(2,4-dimethylphenyl)methylamino]butanamide
CID 115676436
3-[(2,4-dimethylphenyl)methylamino]-3-methylbutanamide
CID 106095989
2-chloro-N-[(2,4-dimethylphenyl)methyl]propanamide
CID 82110635
2-[[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]amino]oxyacetamide
CID 112673832
N-[(2,4-dimethylphenyl)methyl]-2-hydroxyacetamide
CID 82125722
1-[(2,4-dimethylphenyl)methylamino]propan-2-one
CID 115234682
2-(2,4-dimethylphenyl)ethyl carbamate
CID 123427544
(2S)-5-amino-2-[(2,4-dimethylphenyl)methylamino]-5-oxopentanoic acid
CID 67619717
2-amino-N-[(2,4-dimethylphenyl)methyl]propanamide
CID 82126464

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide?
The IUPAC name of 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide (CID 112672487) is 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide.
What is the SMILES notation for 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide?
The canonical SMILES for 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide is Cc1ccc(CNOCC(N)=O)c(C)c1.
What is the InChIKey of 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide?
The InChIKey is CSGHDISYONGQIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8-3-4-10(9(2)5-8)6-13-15-7-11(12)14/h3-5,13H,6-7H2,1-2H3,(H2,12,14).
What are the key properties of 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide?
2-[(2,4-dimethylphenyl)methylamino]oxyacetamide has a molecular weight of 208.26 g/mol, XLogP of 0.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethylphenyl)methylamino]oxyacetamide is sourced from PubChem (CID 112672487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).