2-(2-formylhydrazinyl)-2-oxoacetamide

C3H5N3O3 — CID 13388212

IUPAC2-(2-formylhydrazinyl)-2-oxoacetamide
SMILESNC(=O)C(=O)NNC=O
InChIInChI=1S/C3H5N3O3/c4-2(8)3(9)6-5-1-7/h1H,(H2,4,8)(H,5,7)(H,6,9)
InChIKeyJUFFBDLKDMFRQC-UHFFFAOYSA-N
MW131.09 g/mol
LogP-2.75
Rot. Bonds2

About 2-(2-formylhydrazinyl)-2-oxoacetamide

2-(2-formylhydrazinyl)-2-oxoacetamide (PubChem CID 13388212) has the molecular formula C3H5N3O3 and a molecular weight of 131.09 g/mol. Its IUPAC name is 2-(2-formylhydrazinyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-(2-formylhydrazinyl)-2-oxoacetamide
PubChem CID13388212
Molecular FormulaC3H5N3O3
Molecular Weight131.09 g/mol
Exact Mass131.03
IUPAC Name2-(2-formylhydrazinyl)-2-oxoacetamide
SMILESNC(=O)C(=O)NNC=O
InChIInChI=1S/C3H5N3O3/c4-2(8)3(9)6-5-1-7/h1H,(H2,4,8)(H,5,7)(H,6,9)
InChIKeyJUFFBDLKDMFRQC-UHFFFAOYSA-N
XLogP-2.75
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.09
LogP ≤ 5-2.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', '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 2-(2-formylhydrazinyl)-2-oxoacetamide?
The IUPAC name of 2-(2-formylhydrazinyl)-2-oxoacetamide (CID 13388212) is 2-(2-formylhydrazinyl)-2-oxoacetamide.
What is the SMILES notation for 2-(2-formylhydrazinyl)-2-oxoacetamide?
The canonical SMILES for 2-(2-formylhydrazinyl)-2-oxoacetamide is NC(=O)C(=O)NNC=O.
What is the InChIKey of 2-(2-formylhydrazinyl)-2-oxoacetamide?
The InChIKey is JUFFBDLKDMFRQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5N3O3/c4-2(8)3(9)6-5-1-7/h1H,(H2,4,8)(H,5,7)(H,6,9).
What are the key properties of 2-(2-formylhydrazinyl)-2-oxoacetamide?
2-(2-formylhydrazinyl)-2-oxoacetamide has a molecular weight of 131.09 g/mol, XLogP of -2.75, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-formylhydrazinyl)-2-oxoacetamide is sourced from PubChem (CID 13388212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).