N-ethyl-N',N'-dihydroxyoxamide

C4H8N2O4 — CID 18520297

IUPACN-ethyl-N',N'-dihydroxyoxamide
SMILESCCNC(=O)C(=O)N(O)O
InChIInChI=1S/C4H8N2O4/c1-2-5-3(7)4(8)6(9)10/h9-10H,2H2,1H3,(H,5,7)
InChIKeyGKFJYIJHUZTTHN-UHFFFAOYSA-N
MW148.12 g/mol
LogP-1.27
Rot. Bonds1

About N-ethyl-N',N'-dihydroxyoxamide

N-ethyl-N',N'-dihydroxyoxamide (PubChem CID 18520297) has the molecular formula C4H8N2O4 and a molecular weight of 148.12 g/mol. Its IUPAC name is N-ethyl-N',N'-dihydroxyoxamide.

Molecular Properties

Compound NameN-ethyl-N',N'-dihydroxyoxamide
PubChem CID18520297
Molecular FormulaC4H8N2O4
Molecular Weight148.12 g/mol
Exact Mass148.05
IUPAC NameN-ethyl-N',N'-dihydroxyoxamide
SMILESCCNC(=O)C(=O)N(O)O
InChIInChI=1S/C4H8N2O4/c1-2-5-3(7)4(8)6(9)10/h9-10H,2H2,1H3,(H,5,7)
InChIKeyGKFJYIJHUZTTHN-UHFFFAOYSA-N
XLogP-1.27
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.12
LogP ≤ 5-1.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', '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-ethyl-N',N'-dihydroxyoxamide?
The IUPAC name of N-ethyl-N',N'-dihydroxyoxamide (CID 18520297) is N-ethyl-N',N'-dihydroxyoxamide.
What is the SMILES notation for N-ethyl-N',N'-dihydroxyoxamide?
The canonical SMILES for N-ethyl-N',N'-dihydroxyoxamide is CCNC(=O)C(=O)N(O)O.
What is the InChIKey of N-ethyl-N',N'-dihydroxyoxamide?
The InChIKey is GKFJYIJHUZTTHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O4/c1-2-5-3(7)4(8)6(9)10/h9-10H,2H2,1H3,(H,5,7).
What are the key properties of N-ethyl-N',N'-dihydroxyoxamide?
N-ethyl-N',N'-dihydroxyoxamide has a molecular weight of 148.12 g/mol, XLogP of -1.27, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N',N'-dihydroxyoxamide is sourced from PubChem (CID 18520297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).