[(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide

C6H11N4O2- — CID 163753839

IUPAC[(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide
SMILESC[N-]N(C)C1CC(=NN)C(=O)O1
InChIInChI=1S/C6H11N4O2/c1-8-10(2)5-3-4(9-7)6(11)12-5/h5H,3,7H2,1-2H3/q-1
InChIKeyVWNVWNTYSBFIBC-UHFFFAOYSA-N
MW171.18 g/mol
LogP-0.58
Rot. Bonds2

About [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide

[(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide (PubChem CID 163753839) has the molecular formula C6H11N4O2- and a molecular weight of 171.18 g/mol. Its IUPAC name is [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide.

Molecular Properties

Compound Name[(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide
PubChem CID163753839
Molecular FormulaC6H11N4O2-
Molecular Weight171.18 g/mol
Exact Mass171.09
IUPAC Name[(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide
SMILESC[N-]N(C)C1CC(=NN)C(=O)O1
InChIInChI=1S/C6H11N4O2/c1-8-10(2)5-3-4(9-7)6(11)12-5/h5H,3,7H2,1-2H3/q-1
InChIKeyVWNVWNTYSBFIBC-UHFFFAOYSA-N
XLogP-0.58
TPSA82.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.18
LogP ≤ 5-0.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Ethyl 2-methyl-3,4-dihydropyrazole-5-carboxylate
CID 140972568
[(4-Hydrazinylidene-5-oxooxolan-2-yl)-methylazaniumyl]-methylazanide
CID 163753838

Frequently Asked Questions

What is the IUPAC name of [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide?
The IUPAC name of [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide (CID 163753839) is [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide.
What is the SMILES notation for [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide?
The canonical SMILES for [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide is C[N-]N(C)C1CC(=NN)C(=O)O1.
What is the InChIKey of [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide?
The InChIKey is VWNVWNTYSBFIBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N4O2/c1-8-10(2)5-3-4(9-7)6(11)12-5/h5H,3,7H2,1-2H3/q-1.
What are the key properties of [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide?
[(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide has a molecular weight of 171.18 g/mol, XLogP of -0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-hydrazinylidene-5-oxooxolan-2-yl)-methylamino]-methylazanide is sourced from PubChem (CID 163753839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).