2-(4-acetylpiperazin-1-yl)acetohydrazide

C8H16N4O2 — CID 22479754

IUPAC2-(4-acetylpiperazin-1-yl)acetohydrazide
SMILESCC(=O)N1CCN(CC(=O)NN)CC1
InChIInChI=1S/C8H16N4O2/c1-7(13)12-4-2-11(3-5-12)6-8(14)10-9/h2-6,9H2,1H3,(H,10,14)
InChIKeyKPABORHHRPCFAM-UHFFFAOYSA-N
MW200.24 g/mol
LogP-1.86
Rot. Bonds2

About 2-(4-acetylpiperazin-1-yl)acetohydrazide

2-(4-acetylpiperazin-1-yl)acetohydrazide (PubChem CID 22479754) has the molecular formula C8H16N4O2 and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-(4-acetylpiperazin-1-yl)acetohydrazide.

Molecular Properties

Compound Name2-(4-acetylpiperazin-1-yl)acetohydrazide
PubChem CID22479754
Molecular FormulaC8H16N4O2
Molecular Weight200.24 g/mol
Exact Mass200.13
IUPAC Name2-(4-acetylpiperazin-1-yl)acetohydrazide
SMILESCC(=O)N1CCN(CC(=O)NN)CC1
InChIInChI=1S/C8H16N4O2/c1-7(13)12-4-2-11(3-5-12)6-8(14)10-9/h2-6,9H2,1H3,(H,10,14)
InChIKeyKPABORHHRPCFAM-UHFFFAOYSA-N
XLogP-1.86
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-1.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 2-(4-acetylpiperazin-1-yl)acetohydrazide?
The IUPAC name of 2-(4-acetylpiperazin-1-yl)acetohydrazide (CID 22479754) is 2-(4-acetylpiperazin-1-yl)acetohydrazide.
What is the SMILES notation for 2-(4-acetylpiperazin-1-yl)acetohydrazide?
The canonical SMILES for 2-(4-acetylpiperazin-1-yl)acetohydrazide is CC(=O)N1CCN(CC(=O)NN)CC1.
What is the InChIKey of 2-(4-acetylpiperazin-1-yl)acetohydrazide?
The InChIKey is KPABORHHRPCFAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4O2/c1-7(13)12-4-2-11(3-5-12)6-8(14)10-9/h2-6,9H2,1H3,(H,10,14).
What are the key properties of 2-(4-acetylpiperazin-1-yl)acetohydrazide?
2-(4-acetylpiperazin-1-yl)acetohydrazide has a molecular weight of 200.24 g/mol, XLogP of -1.86, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperazin-1-yl)acetohydrazide is sourced from PubChem (CID 22479754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).