2-[(2-bromoacetyl)amino]oxyacetamide

C4H7BrN2O3 — CID 112673326

IUPAC2-[(2-bromoacetyl)amino]oxyacetamide
SMILESNC(=O)CONC(=O)CBr
InChIInChI=1S/C4H7BrN2O3/c5-1-4(9)7-10-2-3(6)8/h1-2H2,(H2,6,8)(H,7,9)
InChIKeySCAHONYZXKYAGA-UHFFFAOYSA-N
MW211.01 g/mol
LogP-1.09
Rot. Bonds4

About 2-[(2-bromoacetyl)amino]oxyacetamide

2-[(2-bromoacetyl)amino]oxyacetamide (PubChem CID 112673326) has the molecular formula C4H7BrN2O3 and a molecular weight of 211.01 g/mol. Its IUPAC name is 2-[(2-bromoacetyl)amino]oxyacetamide.

Molecular Properties

Compound Name2-[(2-bromoacetyl)amino]oxyacetamide
PubChem CID112673326
Molecular FormulaC4H7BrN2O3
Molecular Weight211.01 g/mol
Exact Mass209.96
IUPAC Name2-[(2-bromoacetyl)amino]oxyacetamide
SMILESNC(=O)CONC(=O)CBr
InChIInChI=1S/C4H7BrN2O3/c5-1-4(9)7-10-2-3(6)8/h1-2H2,(H2,6,8)(H,7,9)
InChIKeySCAHONYZXKYAGA-UHFFFAOYSA-N
XLogP-1.09
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.01
LogP ≤ 5-1.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(2-chloroacetyl)amino]oxyacetamide
CID 112673327
N-(2-amino-2-oxoethoxy)butanamide
CID 112550491
2-[(2-ethoxyacetyl)amino]oxyacetamide
CID 112550612
N-(2-amino-2-oxoethoxy)-3,3-dimethylbutanamide
CID 112550922
4-amino-N-(2-amino-2-oxoethoxy)butanamide
CID 112674157
2-[(2-methylsulfanylacetyl)amino]oxyacetamide
CID 112550699
N-(2-amino-2-oxoethoxy)pentanamide
CID 112550822
2-amino-N-[2-[(2-amino-2-oxoethoxy)amino]-2-oxoethyl]acetamide
CID 112674251
N-(2-amino-2-oxoethoxy)-3-methylsulfanylpropanamide
CID 112551095
N-(2-amino-2-oxoethoxy)-3-(ethylamino)propanamide
CID 112674083
7-amino-N-(2-amino-2-oxoethoxy)heptanamide
CID 112674126
4-[(2-amino-2-oxoethoxy)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 112672362

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromoacetyl)amino]oxyacetamide?
The IUPAC name of 2-[(2-bromoacetyl)amino]oxyacetamide (CID 112673326) is 2-[(2-bromoacetyl)amino]oxyacetamide.
What is the SMILES notation for 2-[(2-bromoacetyl)amino]oxyacetamide?
The canonical SMILES for 2-[(2-bromoacetyl)amino]oxyacetamide is NC(=O)CONC(=O)CBr.
What is the InChIKey of 2-[(2-bromoacetyl)amino]oxyacetamide?
The InChIKey is SCAHONYZXKYAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7BrN2O3/c5-1-4(9)7-10-2-3(6)8/h1-2H2,(H2,6,8)(H,7,9).
What are the key properties of 2-[(2-bromoacetyl)amino]oxyacetamide?
2-[(2-bromoacetyl)amino]oxyacetamide has a molecular weight of 211.01 g/mol, XLogP of -1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromoacetyl)amino]oxyacetamide is sourced from PubChem (CID 112673326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).