N-hydrazinylformamide;hydrate

CH7N3O2 — CID 174810847

IUPACN-hydrazinylformamide;hydrate
SMILESNNNC=O.O
InChIInChI=1S/CH5N3O.H2O/c2-4-3-1-5;/h1,4H,2H2,(H,3,5);1H2
InChIKeyCCPZNVRTKCMAQI-UHFFFAOYSA-N
MW93.09 g/mol
LogP-2.71
Rot. Bonds2

About N-hydrazinylformamide;hydrate

N-hydrazinylformamide;hydrate (PubChem CID 174810847) has the molecular formula CH7N3O2 and a molecular weight of 93.09 g/mol. Its IUPAC name is N-hydrazinylformamide;hydrate.

Molecular Properties

Compound NameN-hydrazinylformamide;hydrate
PubChem CID174810847
Molecular FormulaCH7N3O2
Molecular Weight93.09 g/mol
Exact Mass93.05
IUPAC NameN-hydrazinylformamide;hydrate
SMILESNNNC=O.O
InChIInChI=1S/CH5N3O.H2O/c2-4-3-1-5;/h1,4H,2H2,(H,3,5);1H2
InChIKeyCCPZNVRTKCMAQI-UHFFFAOYSA-N
XLogP-2.71
TPSA98.65 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50093.09
LogP ≤ 5-2.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 N-hydrazinylformamide;hydrate?
The IUPAC name of N-hydrazinylformamide;hydrate (CID 174810847) is N-hydrazinylformamide;hydrate.
What is the SMILES notation for N-hydrazinylformamide;hydrate?
The canonical SMILES for N-hydrazinylformamide;hydrate is NNNC=O.O.
What is the InChIKey of N-hydrazinylformamide;hydrate?
The InChIKey is CCPZNVRTKCMAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/CH5N3O.H2O/c2-4-3-1-5;/h1,4H,2H2,(H,3,5);1H2.
What are the key properties of N-hydrazinylformamide;hydrate?
N-hydrazinylformamide;hydrate has a molecular weight of 93.09 g/mol, XLogP of -2.71, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydrazinylformamide;hydrate is sourced from PubChem (CID 174810847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).