(2E)-2-hydrazinylidene-1-methylimidazolidin-4-one

C4H8N4O — CID 136626142

IUPAC(2E)-2-hydrazinylidene-1-methylimidazolidin-4-one
SMILESCN1CC(=O)N/C1=N\N
InChIInChI=1S/C4H8N4O/c1-8-2-3(9)6-4(8)7-5/h2,5H2,1H3,(H,6,7,9)
InChIKeyDYEVREWWICEGRK-UHFFFAOYSA-N
MW128.13 g/mol
LogP-1.72
Rot. Bonds

About (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one

(2E)-2-hydrazinylidene-1-methylimidazolidin-4-one (PubChem CID 136626142) has the molecular formula C4H8N4O and a molecular weight of 128.13 g/mol. Its IUPAC name is (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one.

Molecular Properties

Compound Name(2E)-2-hydrazinylidene-1-methylimidazolidin-4-one
PubChem CID136626142
Molecular FormulaC4H8N4O
Molecular Weight128.13 g/mol
Exact Mass128.07
IUPAC Name(2E)-2-hydrazinylidene-1-methylimidazolidin-4-one
SMILESCN1CC(=O)N/C1=N\N
InChIInChI=1S/C4H8N4O/c1-8-2-3(9)6-4(8)7-5/h2,5H2,1H3,(H,6,7,9)
InChIKeyDYEVREWWICEGRK-UHFFFAOYSA-N
XLogP-1.72
TPSA70.72 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 5-1.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one?
The IUPAC name of (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one (CID 136626142) is (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one.
What is the SMILES notation for (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one?
The canonical SMILES for (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one is CN1CC(=O)N/C1=N\N.
What is the InChIKey of (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one?
The InChIKey is DYEVREWWICEGRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4O/c1-8-2-3(9)6-4(8)7-5/h2,5H2,1H3,(H,6,7,9).
What are the key properties of (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one?
(2E)-2-hydrazinylidene-1-methylimidazolidin-4-one has a molecular weight of 128.13 g/mol, XLogP of -1.72, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-hydrazinylidene-1-methylimidazolidin-4-one is sourced from PubChem (CID 136626142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).