N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide

C16H36N8O2 — CID 159081191

IUPACN'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide
SMILESCNNC(=O)CN1CCN(C)CC1.CNNC(=O)CN1CCN(C)CC1
InChIInChI=1S/2C8H18N4O/c2*1-9-10-8(13)7-12-5-3-11(2)4-6-12/h2*9H,3-7H2,1-2H3,(H,10,13)
InChIKeyKAWJWLLMVYDVOM-UHFFFAOYSA-N
MW372.52 g/mol
LogP-3.03
Rot. Bonds6

About N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide

N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide (PubChem CID 159081191) has the molecular formula C16H36N8O2 and a molecular weight of 372.52 g/mol. Its IUPAC name is N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide.

Molecular Properties

Compound NameN'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide
PubChem CID159081191
Molecular FormulaC16H36N8O2
Molecular Weight372.52 g/mol
Exact Mass372.30
IUPAC NameN'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide
SMILESCNNC(=O)CN1CCN(C)CC1.CNNC(=O)CN1CCN(C)CC1
InChIInChI=1S/2C8H18N4O/c2*1-9-10-8(13)7-12-5-3-11(2)4-6-12/h2*9H,3-7H2,1-2H3,(H,10,13)
InChIKeyKAWJWLLMVYDVOM-UHFFFAOYSA-N
XLogP-3.03
TPSA95.22 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.52
LogP ≤ 5-3.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

N-(4-methylpiperazin-1-yl)-2-piperazin-1-ylacetamide
CID 53700423
N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide
CID 59817251
N'-acetyl-2-(4-methylpiperazin-1-yl)acetohydrazide
CID 70311898
2-[4-(2-Hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide
CID 129104105
methane;N-methyl-2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)acetohydrazide
CID 158301673
N-(2-aminoethyl)-2-(4-methylpiperazin-1-yl)acetamide;2-(4-methylpiperazin-1-yl)acetohydrazide
CID 158397719
N-(2-aminoethyl)-2-(4-methylpiperazin-1-yl)acetamide;methane;2-(4-methylpiperazin-1-yl)acetohydrazide
CID 158595471
2-(4,4-Dimethylpiperazine-1,4-diium-1-yl)acetohydrazide
CID 162458856
[2-[4-(2-Hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetyl]azanium
CID 163937718
2-[4-[2-(4-Methyl-1-oxidopiperazin-1-ium-1-yl)ethyl]-1-[2-(4-propylpiperazin-1-yl)ethyl]piperazin-1-ium-1-yl]acetohydrazide
CID 164793040
Methane;2-[4-[2-(4-methyl-1-oxidopiperazin-1-ium-1-yl)ethyl]-1-[2-(4-propylpiperazin-1-yl)ethyl]piperazin-1-ium-1-yl]acetohydrazide
CID 165036756
N'-acetyl-2-piperazin-1-ylacetohydrazide
CID 43168630

Frequently Asked Questions

What is the IUPAC name of N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide?
The IUPAC name of N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide (CID 159081191) is N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide.
What is the SMILES notation for N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide?
The canonical SMILES for N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide is CNNC(=O)CN1CCN(C)CC1.CNNC(=O)CN1CCN(C)CC1.
What is the InChIKey of N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide?
The InChIKey is KAWJWLLMVYDVOM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H18N4O/c2*1-9-10-8(13)7-12-5-3-11(2)4-6-12/h2*9H,3-7H2,1-2H3,(H,10,13).
What are the key properties of N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide?
N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide has a molecular weight of 372.52 g/mol, XLogP of -3.03, 6 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-2-(4-methylpiperazin-1-yl)acetohydrazide is sourced from PubChem (CID 159081191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).