2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide

C7H14N4O2 — CID 2760035

IUPAC2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide
SMILESCN1CCN(C(=O)C(=O)NN)CC1
InChIInChI=1S/C7H14N4O2/c1-10-2-4-11(5-3-10)7(13)6(12)9-8/h2-5,8H2,1H3,(H,9,12)
InChIKeyOVERGYQUZISQEP-UHFFFAOYSA-N
MW186.21 g/mol
LogP-2.25
Rot. Bonds

About 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide

2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide (PubChem CID 2760035) has the molecular formula C7H14N4O2 and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide.

Molecular Properties

Compound Name2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide
PubChem CID2760035
Molecular FormulaC7H14N4O2
Molecular Weight186.21 g/mol
Exact Mass186.11
IUPAC Name2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide
SMILESCN1CCN(C(=O)C(=O)NN)CC1
InChIInChI=1S/C7H14N4O2/c1-10-2-4-11(5-3-10)7(13)6(12)9-8/h2-5,8H2,1H3,(H,9,12)
InChIKeyOVERGYQUZISQEP-UHFFFAOYSA-N
XLogP-2.25
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-2.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-methylpiperazin-1-yl)-2-oxo-N-propan-2-ylacetamide
CID 108503261
N-(1-hydroxy-2-methylpropan-2-yl)-2-(4-methylpiperazin-1-yl)-2-oxoacetamide
CID 108517189
2-(4-methylpiperazin-1-yl)-2-oxo-N-prop-2-enylacetamide
CID 108517092
2-(4-methylpiperazin-1-yl)-2-oxo-N-pentylacetamide
CID 108517060
1-(4-methylpiperazin-1-yl)ethanone
CID 550758
N-methylmethanamine;1-(4-methylpiperazin-1-yl)ethanone
CID 160870034
N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide
CID 108509776
4-[2-(4-methylpiperazin-1-yl)-2-oxoacetyl]piperazine-1-carbaldehyde
CID 108517141
N-[(4-methylphenyl)methyl]-2-(4-methylpiperazin-1-yl)-2-oxoacetamide
CID 108517042
N-(4-anilinophenyl)-2-(4-methylpiperazin-1-yl)-2-oxoacetamide
CID 108517085
2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoacetohydrazide
CID 54936333
2-(3-methoxy-3-methylazetidin-1-yl)-2-oxoacetohydrazide
CID 131091735

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide?
The IUPAC name of 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide (CID 2760035) is 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide.
What is the SMILES notation for 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide?
The canonical SMILES for 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide is CN1CCN(C(=O)C(=O)NN)CC1.
What is the InChIKey of 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide?
The InChIKey is OVERGYQUZISQEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O2/c1-10-2-4-11(5-3-10)7(13)6(12)9-8/h2-5,8H2,1H3,(H,9,12).
What are the key properties of 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide?
2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide has a molecular weight of 186.21 g/mol, XLogP of -2.25, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpiperazin-1-yl)-2-oxoacetohydrazide is sourced from PubChem (CID 2760035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).