2-hydrazinylpropanedihydrazide

C3H10N6O2 — CID 55280473

IUPAC2-hydrazinylpropanedihydrazide
SMILESNNC(=O)C(NN)C(=O)NN
InChIInChI=1S/C3H10N6O2/c4-7-1(2(10)8-5)3(11)9-6/h1,7H,4-6H2,(H,8,10)(H,9,11)
InChIKeyXKWSJAAGMNYJIH-UHFFFAOYSA-N
MW162.15 g/mol
LogP-4.20
Rot. Bonds3

About 2-hydrazinylpropanedihydrazide

2-hydrazinylpropanedihydrazide (PubChem CID 55280473) has the molecular formula C3H10N6O2 and a molecular weight of 162.15 g/mol. Its IUPAC name is 2-hydrazinylpropanedihydrazide.

Molecular Properties

Compound Name2-hydrazinylpropanedihydrazide
PubChem CID55280473
Molecular FormulaC3H10N6O2
Molecular Weight162.15 g/mol
Exact Mass162.09
IUPAC Name2-hydrazinylpropanedihydrazide
SMILESNNC(=O)C(NN)C(=O)NN
InChIInChI=1S/C3H10N6O2/c4-7-1(2(10)8-5)3(11)9-6/h1,7H,4-6H2,(H,8,10)(H,9,11)
InChIKeyXKWSJAAGMNYJIH-UHFFFAOYSA-N
XLogP-4.20
TPSA148.29 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500162.15
LogP ≤ 5-4.20
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

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-hydrazinylpropanedihydrazide?
The IUPAC name of 2-hydrazinylpropanedihydrazide (CID 55280473) is 2-hydrazinylpropanedihydrazide.
What is the SMILES notation for 2-hydrazinylpropanedihydrazide?
The canonical SMILES for 2-hydrazinylpropanedihydrazide is NNC(=O)C(NN)C(=O)NN.
What is the InChIKey of 2-hydrazinylpropanedihydrazide?
The InChIKey is XKWSJAAGMNYJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N6O2/c4-7-1(2(10)8-5)3(11)9-6/h1,7H,4-6H2,(H,8,10)(H,9,11).
What are the key properties of 2-hydrazinylpropanedihydrazide?
2-hydrazinylpropanedihydrazide has a molecular weight of 162.15 g/mol, XLogP of -4.20, 3 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinylpropanedihydrazide is sourced from PubChem (CID 55280473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).