N'-(2-aminophenoxy)oxamide

C8H9N3O3 — CID 19845141

IUPACN'-(2-aminophenoxy)oxamide
SMILESNC(=O)C(=O)NOc1ccccc1N
InChIInChI=1S/C8H9N3O3/c9-5-3-1-2-4-6(5)14-11-8(13)7(10)12/h1-4H,9H2,(H2,10,12)(H,11,13)
InChIKeyKFFIRJVNPORUJI-UHFFFAOYSA-N
MW195.18 g/mol
LogP-0.84
Rot. Bonds2

About N'-(2-aminophenoxy)oxamide

N'-(2-aminophenoxy)oxamide (PubChem CID 19845141) has the molecular formula C8H9N3O3 and a molecular weight of 195.18 g/mol. Its IUPAC name is N'-(2-aminophenoxy)oxamide.

Molecular Properties

Compound NameN'-(2-aminophenoxy)oxamide
PubChem CID19845141
Molecular FormulaC8H9N3O3
Molecular Weight195.18 g/mol
Exact Mass195.06
IUPAC NameN'-(2-aminophenoxy)oxamide
SMILESNC(=O)C(=O)NOc1ccccc1N
InChIInChI=1S/C8H9N3O3/c9-5-3-1-2-4-6(5)14-11-8(13)7(10)12/h1-4H,9H2,(H2,10,12)(H,11,13)
InChIKeyKFFIRJVNPORUJI-UHFFFAOYSA-N
XLogP-0.84
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 5-0.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2-aminophenoxy)oxamide?
The IUPAC name of N'-(2-aminophenoxy)oxamide (CID 19845141) is N'-(2-aminophenoxy)oxamide.
What is the SMILES notation for N'-(2-aminophenoxy)oxamide?
The canonical SMILES for N'-(2-aminophenoxy)oxamide is NC(=O)C(=O)NOc1ccccc1N.
What is the InChIKey of N'-(2-aminophenoxy)oxamide?
The InChIKey is KFFIRJVNPORUJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O3/c9-5-3-1-2-4-6(5)14-11-8(13)7(10)12/h1-4H,9H2,(H2,10,12)(H,11,13).
What are the key properties of N'-(2-aminophenoxy)oxamide?
N'-(2-aminophenoxy)oxamide has a molecular weight of 195.18 g/mol, XLogP of -0.84, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-aminophenoxy)oxamide is sourced from PubChem (CID 19845141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).