3-methoxy-2-piperazin-1-ylpropanehydrazide

C8H18N4O2 — CID 103229611

IUPAC3-methoxy-2-piperazin-1-ylpropanehydrazide
SMILESCOCC(C(=O)NN)N1CCNCC1
InChIInChI=1S/C8H18N4O2/c1-14-6-7(8(13)11-9)12-4-2-10-3-5-12/h7,10H,2-6,9H2,1H3,(H,11,13)
InChIKeyILRGMHBIQJZCEC-UHFFFAOYSA-N
MW202.26 g/mol
LogP-2.10
Rot. Bonds4

About 3-methoxy-2-piperazin-1-ylpropanehydrazide

3-methoxy-2-piperazin-1-ylpropanehydrazide (PubChem CID 103229611) has the molecular formula C8H18N4O2 and a molecular weight of 202.26 g/mol. Its IUPAC name is 3-methoxy-2-piperazin-1-ylpropanehydrazide.

Molecular Properties

Compound Name3-methoxy-2-piperazin-1-ylpropanehydrazide
PubChem CID103229611
Molecular FormulaC8H18N4O2
Molecular Weight202.26 g/mol
Exact Mass202.14
IUPAC Name3-methoxy-2-piperazin-1-ylpropanehydrazide
SMILESCOCC(C(=O)NN)N1CCNCC1
InChIInChI=1S/C8H18N4O2/c1-14-6-7(8(13)11-9)12-4-2-10-3-5-12/h7,10H,2-6,9H2,1H3,(H,11,13)
InChIKeyILRGMHBIQJZCEC-UHFFFAOYSA-N
XLogP-2.10
TPSA79.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 5-2.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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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Related Compounds

2-(4-acetylpiperazin-1-yl)-3-methoxypropanehydrazide
CID 103229435
3-methoxy-2-(4-methylpiperidin-1-yl)propanehydrazide
CID 103229441
3-methoxy-2-(3-oxopiperazin-1-yl)propanehydrazide
CID 103229454
2-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]-3-methoxypropanehydrazide
CID 103229714
3-methoxy-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]propanehydrazide
CID 103229575
2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-3-methoxypropanehydrazide
CID 103229530
3-methoxy-2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)propanehydrazide
CID 103229742
3-methoxy-2-[3-(methoxymethyl)piperidin-1-yl]propanehydrazide
CID 106589687
3-methoxy-2-(2-methyl-1,4-oxazepan-4-yl)propanehydrazide
CID 103229582
3-methoxy-2-[4-(3-methylphenyl)piperazin-1-yl]propanehydrazide
CID 103229457
2-[3-(2-hydroxyethyl)piperidin-1-yl]-3-methoxypropanehydrazide
CID 107229100
methyl 2-(1,4-diazepan-1-yl)-3-hydroxypropanoate
CID 104711236

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-piperazin-1-ylpropanehydrazide?
The IUPAC name of 3-methoxy-2-piperazin-1-ylpropanehydrazide (CID 103229611) is 3-methoxy-2-piperazin-1-ylpropanehydrazide.
What is the SMILES notation for 3-methoxy-2-piperazin-1-ylpropanehydrazide?
The canonical SMILES for 3-methoxy-2-piperazin-1-ylpropanehydrazide is COCC(C(=O)NN)N1CCNCC1.
What is the InChIKey of 3-methoxy-2-piperazin-1-ylpropanehydrazide?
The InChIKey is ILRGMHBIQJZCEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O2/c1-14-6-7(8(13)11-9)12-4-2-10-3-5-12/h7,10H,2-6,9H2,1H3,(H,11,13).
What are the key properties of 3-methoxy-2-piperazin-1-ylpropanehydrazide?
3-methoxy-2-piperazin-1-ylpropanehydrazide has a molecular weight of 202.26 g/mol, XLogP of -2.10, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-piperazin-1-ylpropanehydrazide is sourced from PubChem (CID 103229611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).