formohydrazide;hydrate

CH6N2O2 — CID 141312423

IUPACformohydrazide;hydrate
SMILESNNC=O.O
InChIInChI=1S/CH4N2O.H2O/c2-3-1-4;/h1H,2H2,(H,3,4);1H2
InChIKeyOCCJQBPNYAFZQD-UHFFFAOYSA-N
MW78.07 g/mol
LogP-2.22
Rot. Bonds1

About formohydrazide;hydrate

formohydrazide;hydrate (PubChem CID 141312423) has the molecular formula CH6N2O2 and a molecular weight of 78.07 g/mol. Its IUPAC name is formohydrazide;hydrate.

Molecular Properties

Compound Nameformohydrazide;hydrate
PubChem CID141312423
Molecular FormulaCH6N2O2
Molecular Weight78.07 g/mol
Exact Mass78.04
IUPAC Nameformohydrazide;hydrate
SMILESNNC=O.O
InChIInChI=1S/CH4N2O.H2O/c2-3-1-4;/h1H,2H2,(H,3,4);1H2
InChIKeyOCCJQBPNYAFZQD-UHFFFAOYSA-N
XLogP-2.22
TPSA86.62 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50078.07
LogP ≤ 5-2.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', '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 formohydrazide;hydrate?
The IUPAC name of formohydrazide;hydrate (CID 141312423) is formohydrazide;hydrate.
What is the SMILES notation for formohydrazide;hydrate?
The canonical SMILES for formohydrazide;hydrate is NNC=O.O.
What is the InChIKey of formohydrazide;hydrate?
The InChIKey is OCCJQBPNYAFZQD-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4N2O.H2O/c2-3-1-4;/h1H,2H2,(H,3,4);1H2.
What are the key properties of formohydrazide;hydrate?
formohydrazide;hydrate has a molecular weight of 78.07 g/mol, XLogP of -2.22, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formohydrazide;hydrate is sourced from PubChem (CID 141312423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).