5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide

C10H20N4O2 — CID 4740808

IUPAC5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide
SMILESCN1CCN(C(=O)CCCC(=O)NN)CC1
InChIInChI=1S/C10H20N4O2/c1-13-5-7-14(8-6-13)10(16)4-2-3-9(15)12-11/h2-8,11H2,1H3,(H,12,15)
InChIKeyFVCOQASWMDEEBM-UHFFFAOYSA-N
MW228.30 g/mol
LogP-1.08
Rot. Bonds4

About 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide

5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide (PubChem CID 4740808) has the molecular formula C10H20N4O2 and a molecular weight of 228.30 g/mol. Its IUPAC name is 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide.

Molecular Properties

Compound Name5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide
PubChem CID4740808
Molecular FormulaC10H20N4O2
Molecular Weight228.30 g/mol
Exact Mass228.16
IUPAC Name5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide
SMILESCN1CCN(C(=O)CCCC(=O)NN)CC1
InChIInChI=1S/C10H20N4O2/c1-13-5-7-14(8-6-13)10(16)4-2-3-9(15)12-11/h2-8,11H2,1H3,(H,12,15)
InChIKeyFVCOQASWMDEEBM-UHFFFAOYSA-N
XLogP-1.08
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 5-1.08
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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Related Compounds

5-[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]pentanehydrazide
CID 63584826
N-(4-methylpiperazin-1-yl)pentanamide
CID 5147663
2-(2-Oxopiperidin-1-yl)acetohydrazide
CID 13150938
3-(2,6-Dioxopiperidin-1-yl)propanehydrazide
CID 23136080
N'-(2-piperazin-1-ylacetyl)pentanehydrazide
CID 91186033
N'-(2-piperidin-1-ylacetyl)pentanehydrazide
CID 91481211
N'-methyl-2-(2-oxopiperidin-1-yl)acetohydrazide
CID 117801694
N-(2-Oxo-1-piperidinyl)acetamide
CID 127013701
1-[2-(Methylamino)propanoyl]diazinane-3-carboxamide
CID 134235312
5-(4-Formylpiperazin-1-yl)-2,4,4-trimethyl-5-oxopentanehydrazide
CID 134268874
1-Acetylpiperidine-2-carbohydrazide;ethane
CID 144674853
1-Acetylpiperidine-2-carbohydrazide;ethane
CID 144674875

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide?
The IUPAC name of 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide (CID 4740808) is 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide.
What is the SMILES notation for 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide?
The canonical SMILES for 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide is CN1CCN(C(=O)CCCC(=O)NN)CC1.
What is the InChIKey of 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide?
The InChIKey is FVCOQASWMDEEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O2/c1-13-5-7-14(8-6-13)10(16)4-2-3-9(15)12-11/h2-8,11H2,1H3,(H,12,15).
What are the key properties of 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide?
5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide has a molecular weight of 228.30 g/mol, XLogP of -1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperazin-1-yl)-5-oxopentanehydrazide is sourced from PubChem (CID 4740808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).