2-[2-(4-bromophenoxy)ethylamino]oxyacetamide

C10H13BrN2O3 — CID 112674010

IUPAC2-[2-(4-bromophenoxy)ethylamino]oxyacetamide
SMILESNC(=O)CONCCOc1ccc(Br)cc1
InChIInChI=1S/C10H13BrN2O3/c11-8-1-3-9(4-2-8)15-6-5-13-16-7-10(12)14/h1-4,13H,5-7H2,(H2,12,14)
InChIKeyDVISFUZGCAHAMA-UHFFFAOYSA-N
MW289.13 g/mol
LogP0.83
Rot. Bonds7

About 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide

2-[2-(4-bromophenoxy)ethylamino]oxyacetamide (PubChem CID 112674010) has the molecular formula C10H13BrN2O3 and a molecular weight of 289.13 g/mol. Its IUPAC name is 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide.

Molecular Properties

Compound Name2-[2-(4-bromophenoxy)ethylamino]oxyacetamide
PubChem CID112674010
Molecular FormulaC10H13BrN2O3
Molecular Weight289.13 g/mol
Exact Mass288.01
IUPAC Name2-[2-(4-bromophenoxy)ethylamino]oxyacetamide
SMILESNC(=O)CONCCOc1ccc(Br)cc1
InChIInChI=1S/C10H13BrN2O3/c11-8-1-3-9(4-2-8)15-6-5-13-16-7-10(12)14/h1-4,13H,5-7H2,(H2,12,14)
InChIKeyDVISFUZGCAHAMA-UHFFFAOYSA-N
XLogP0.83
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.13
LogP ≤ 50.83
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-(4-bromophenyl)phenoxy]acetamide
CID 7949184
2-[2-[2-[2-(4-bromophenoxy)ethoxy]ethoxy]ethoxy]ethyl hydrogen carbonate
CID 153491025
2-[2-(4-bromophenoxy)ethylamino]guanidine
CID 95475441
2-[2-(4-bromophenoxy)ethylamino]acetic acid
CID 43466024
3-[[2-(4-bromophenoxy)acetyl]amino]propanamide
CID 122142658
[[2-(4-bromophenoxy)acetyl]amino]thiourea
CID 46706012
2-[[2-(4-bromophenoxy)acetyl]amino]acetamide
CID 9011663
2-(4-bromophenoxy)ethyl 2-(4-chlorophenoxy)acetate
CID 2363711
4-[2-[2-(2-amino-2-oxoethoxy)ethylamino]ethoxy]benzoic acid
CID 106238465
2-(4-bromophenoxy)-N-(3-phenoxypropyl)acetamide
CID 9245994
2-(2-methoxyethylamino)oxyacetamide
CID 112673653
2-[(4-ethoxyphenyl)methylamino]oxyacetamide
CID 112673119

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide?
The IUPAC name of 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide (CID 112674010) is 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide.
What is the SMILES notation for 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide?
The canonical SMILES for 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide is NC(=O)CONCCOc1ccc(Br)cc1.
What is the InChIKey of 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide?
The InChIKey is DVISFUZGCAHAMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O3/c11-8-1-3-9(4-2-8)15-6-5-13-16-7-10(12)14/h1-4,13H,5-7H2,(H2,12,14).
What are the key properties of 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide?
2-[2-(4-bromophenoxy)ethylamino]oxyacetamide has a molecular weight of 289.13 g/mol, XLogP of 0.83, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-bromophenoxy)ethylamino]oxyacetamide is sourced from PubChem (CID 112674010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).