4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide

C8H16N4O2 — CID 63577277

IUPAC4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide
SMILESCN1CCN(CCCC(=O)NN)C1=O
InChIInChI=1S/C8H16N4O2/c1-11-5-6-12(8(11)14)4-2-3-7(13)10-9/h2-6,9H2,1H3,(H,10,13)
InChIKeyZXLGMMRRIKAQIK-UHFFFAOYSA-N
MW200.24 g/mol
LogP-0.88
Rot. Bonds4

About 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide

4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide (PubChem CID 63577277) has the molecular formula C8H16N4O2 and a molecular weight of 200.24 g/mol. Its IUPAC name is 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide.

Molecular Properties

Compound Name4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide
PubChem CID63577277
Molecular FormulaC8H16N4O2
Molecular Weight200.24 g/mol
Exact Mass200.13
IUPAC Name4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide
SMILESCN1CCN(CCCC(=O)NN)C1=O
InChIInChI=1S/C8H16N4O2/c1-11-5-6-12(8(11)14)4-2-3-7(13)10-9/h2-6,9H2,1H3,(H,10,13)
InChIKeyZXLGMMRRIKAQIK-UHFFFAOYSA-N
XLogP-0.88
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-0.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', '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 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide?
The IUPAC name of 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide (CID 63577277) is 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide.
What is the SMILES notation for 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide?
The canonical SMILES for 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide is CN1CCN(CCCC(=O)NN)C1=O.
What is the InChIKey of 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide?
The InChIKey is ZXLGMMRRIKAQIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4O2/c1-11-5-6-12(8(11)14)4-2-3-7(13)10-9/h2-6,9H2,1H3,(H,10,13).
What are the key properties of 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide?
4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide has a molecular weight of 200.24 g/mol, XLogP of -0.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide is sourced from PubChem (CID 63577277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).