2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid

C4H6N2O4 — CID 56609597

IUPAC2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid
SMILESNC(=O)C=NOCC(=O)O
InChIInChI=1S/C4H6N2O4/c5-3(7)1-6-10-2-4(8)9/h1H,2H2,(H2,5,7)(H,8,9)
InChIKeyDHPMQVMBJYSZLF-UHFFFAOYSA-N
MW146.10 g/mol
LogP-1.44
Rot. Bonds4

About 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid

2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid (PubChem CID 56609597) has the molecular formula C4H6N2O4 and a molecular weight of 146.10 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid
PubChem CID56609597
Molecular FormulaC4H6N2O4
Molecular Weight146.10 g/mol
Exact Mass146.03
IUPAC Name2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid
SMILESNC(=O)C=NOCC(=O)O
InChIInChI=1S/C4H6N2O4/c5-3(7)1-6-10-2-4(8)9/h1H,2H2,(H2,5,7)(H,8,9)
InChIKeyDHPMQVMBJYSZLF-UHFFFAOYSA-N
XLogP-1.44
TPSA101.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.10
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-hydroperoxyiminoacetamide
CID 141143472
2-[(E)-[(2E)-2-hydroxyiminoethylidene]amino]oxyacetic acid
CID 135966152
2-[[4-(2-amino-2-oxoethoxy)phenyl]methylideneamino]oxyacetic acid
CID 77013169
2-[(5-methylfuran-2-yl)methylideneamino]oxyacetic acid
CID 77013391
2-[(4-acetamidophenyl)methylideneamino]oxyacetic acid
CID 77013496
(2E)-2-[(2-amino-5-chloro-1,3-thiazol-4-yl)methoxyimino]acetamide
CID 142784741
2-[(2-bromophenyl)methylideneamino]oxyacetic acid
CID 2336636
2-[(E)-(2-tert-butyl-4-methylpentylidene)amino]oxyacetic acid
CID 143400941
2-(naphthalen-1-ylmethylideneamino)oxyacetic acid
CID 78953890
2-[(E)-(6-methyl-3-pyridinyl)methylideneamino]oxyacetic acid
CID 104823667
2-(naphthalen-2-ylmethylideneamino)oxyacetic acid
CID 77013552
2-[(3,5,6-trihydroxy-2,4-dimethylhexylidene)amino]oxyacetic acid
CID 123356072

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid?
The IUPAC name of 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid (CID 56609597) is 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid.
What is the SMILES notation for 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid?
The canonical SMILES for 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid is NC(=O)C=NOCC(=O)O.
What is the InChIKey of 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid?
The InChIKey is DHPMQVMBJYSZLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2O4/c5-3(7)1-6-10-2-4(8)9/h1H,2H2,(H2,5,7)(H,8,9).
What are the key properties of 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid?
2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid has a molecular weight of 146.10 g/mol, XLogP of -1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethylidene)amino]oxyacetic acid is sourced from PubChem (CID 56609597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).