2-amino-3-hydrazinyl-3-oxopropanamide

C3H8N4O2 — CID 163693394

IUPAC2-amino-3-hydrazinyl-3-oxopropanamide
SMILESNNC(=O)C(N)C(N)=O
InChIInChI=1S/C3H8N4O2/c4-1(2(5)8)3(9)7-6/h1H,4,6H2,(H2,5,8)(H,7,9)
InChIKeyJUXBCEBZMQAMNX-UHFFFAOYSA-N
MW132.12 g/mol
LogP-3.21
Rot. Bonds2

About 2-amino-3-hydrazinyl-3-oxopropanamide

2-amino-3-hydrazinyl-3-oxopropanamide (PubChem CID 163693394) has the molecular formula C3H8N4O2 and a molecular weight of 132.12 g/mol. Its IUPAC name is 2-amino-3-hydrazinyl-3-oxopropanamide.

Molecular Properties

Compound Name2-amino-3-hydrazinyl-3-oxopropanamide
PubChem CID163693394
Molecular FormulaC3H8N4O2
Molecular Weight132.12 g/mol
Exact Mass132.06
IUPAC Name2-amino-3-hydrazinyl-3-oxopropanamide
SMILESNNC(=O)C(N)C(N)=O
InChIInChI=1S/C3H8N4O2/c4-1(2(5)8)3(9)7-6/h1H,4,6H2,(H2,5,8)(H,7,9)
InChIKeyJUXBCEBZMQAMNX-UHFFFAOYSA-N
XLogP-3.21
TPSA124.23 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.12
LogP ≤ 5-3.21
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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-amino-3-hydrazinyl-3-oxopropanamide?
The IUPAC name of 2-amino-3-hydrazinyl-3-oxopropanamide (CID 163693394) is 2-amino-3-hydrazinyl-3-oxopropanamide.
What is the SMILES notation for 2-amino-3-hydrazinyl-3-oxopropanamide?
The canonical SMILES for 2-amino-3-hydrazinyl-3-oxopropanamide is NNC(=O)C(N)C(N)=O.
What is the InChIKey of 2-amino-3-hydrazinyl-3-oxopropanamide?
The InChIKey is JUXBCEBZMQAMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N4O2/c4-1(2(5)8)3(9)7-6/h1H,4,6H2,(H2,5,8)(H,7,9).
What are the key properties of 2-amino-3-hydrazinyl-3-oxopropanamide?
2-amino-3-hydrazinyl-3-oxopropanamide has a molecular weight of 132.12 g/mol, XLogP of -3.21, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-hydrazinyl-3-oxopropanamide is sourced from PubChem (CID 163693394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).