2-[(4-ethoxyphenyl)methylamino]oxyacetamide

C11H16N2O3 — CID 112673119

IUPAC2-[(4-ethoxyphenyl)methylamino]oxyacetamide
SMILESCCOc1ccc(CNOCC(N)=O)cc1
InChIInChI=1S/C11H16N2O3/c1-2-15-10-5-3-9(4-6-10)7-13-16-8-11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14)
InChIKeyNTVDKINCBKLDKO-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.59
Rot. Bonds7

About 2-[(4-ethoxyphenyl)methylamino]oxyacetamide

2-[(4-ethoxyphenyl)methylamino]oxyacetamide (PubChem CID 112673119) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-[(4-ethoxyphenyl)methylamino]oxyacetamide.

Molecular Properties

Compound Name2-[(4-ethoxyphenyl)methylamino]oxyacetamide
PubChem CID112673119
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name2-[(4-ethoxyphenyl)methylamino]oxyacetamide
SMILESCCOc1ccc(CNOCC(N)=O)cc1
InChIInChI=1S/C11H16N2O3/c1-2-15-10-5-3-9(4-6-10)7-13-16-8-11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14)
InChIKeyNTVDKINCBKLDKO-UHFFFAOYSA-N
XLogP0.59
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[[4-(trifluoromethoxy)phenyl]methylamino]oxyacetamide
CID 112673035
2-[(4-phenylphenyl)methylamino]oxyacetamide
CID 112673244
N'-[(4-ethoxyphenyl)methyl]oxamide
CID 115191812
4-[(4-ethoxyphenyl)methylamino]butanamide
CID 60863018
3-(4-ethoxyphenyl)propanamide;hydrochloride
CID 172679140
N,N'-bis[(4-ethoxyphenyl)methyl]oxamide
CID 125144939
2-[(4-ethoxyphenyl)sulfonylamino]oxyacetamide
CID 112673488
2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide
CID 43738439
2-[(3,4-dichlorophenyl)methylamino]oxyacetamide
CID 112672874
3-[(4-ethoxyphenyl)methylamino]benzamide
CID 28650475
1-[(4-ethoxyphenyl)methyl]-3-ethylurea
CID 108884423
4-ethoxy-N-[[4-[[(4-ethoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 3528873

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethoxyphenyl)methylamino]oxyacetamide?
The IUPAC name of 2-[(4-ethoxyphenyl)methylamino]oxyacetamide (CID 112673119) is 2-[(4-ethoxyphenyl)methylamino]oxyacetamide.
What is the SMILES notation for 2-[(4-ethoxyphenyl)methylamino]oxyacetamide?
The canonical SMILES for 2-[(4-ethoxyphenyl)methylamino]oxyacetamide is CCOc1ccc(CNOCC(N)=O)cc1.
What is the InChIKey of 2-[(4-ethoxyphenyl)methylamino]oxyacetamide?
The InChIKey is NTVDKINCBKLDKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-2-15-10-5-3-9(4-6-10)7-13-16-8-11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14).
What are the key properties of 2-[(4-ethoxyphenyl)methylamino]oxyacetamide?
2-[(4-ethoxyphenyl)methylamino]oxyacetamide has a molecular weight of 224.26 g/mol, XLogP of 0.59, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethoxyphenyl)methylamino]oxyacetamide is sourced from PubChem (CID 112673119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).