2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide

C10H24N6O2+2 — CID 129104105

IUPAC2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide
SMILESC[N+]1(CC(=O)NN)CC[N+](C)(CC(=O)NN)CC1
InChIInChI=1S/C10H22N6O2/c1-15(7-9(17)13-11)3-5-16(2,6-4-15)8-10(18)14-12/h3-8,11-12H2,1-2H3/p+2
InChIKeyLDKJMXOGALTIGE-UHFFFAOYSA-P
MW260.34 g/mol
LogP-3.13
Rot. Bonds4

About 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide

2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide (PubChem CID 129104105) has the molecular formula C10H24N6O2+2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide.

Molecular Properties

Compound Name2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide
PubChem CID129104105
Molecular FormulaC10H24N6O2+2
Molecular Weight260.34 g/mol
Exact Mass260.19
IUPAC Name2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide
SMILESC[N+]1(CC(=O)NN)CC[N+](C)(CC(=O)NN)CC1
InChIInChI=1S/C10H22N6O2/c1-15(7-9(17)13-11)3-5-16(2,6-4-15)8-10(18)14-12/h3-8,11-12H2,1-2H3/p+2
InChIKeyLDKJMXOGALTIGE-UHFFFAOYSA-P
XLogP-3.13
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 5-3.13
H-Bond Donors ≤ 54
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'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

N,N-Bis(2-hydrazinyl-2-oxoethyl)glycine hydrazide
CID 72719
Glycine, N,N-dipropyl-, hydrazide
CID 17542
1-Piperazineacetic acid, 4-methyl-, hydrazide
CID 90566
2-(Piperazin-1-yl)acetohydrazide
CID 45099474
2-[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]acetohydrazide
CID 63584268
N1-(tert-butyl)-N2-(4-methylpiperazin-1-yl)oxalamide
CID 45000132
N-(4-methylpiperazin-1-yl)propanamide
CID 5054390
(2-Hydrazinyl-2-oxoethyl)-tripropylazanium
CID 13743712
N-(4-acetylpiperazin-1-yl)acetamide
CID 18683344
N-methyl-2-piperazin-1-ylacetohydrazide
CID 19778604
2-(4-Methylpiperazin-1-yl)propanehydrazide
CID 19778611
2-hydrazinyl-N-(4-methylpiperazin-1-yl)-2-oxoacetamide
CID 20242942

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide?
The IUPAC name of 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide (CID 129104105) is 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide.
What is the SMILES notation for 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide?
The canonical SMILES for 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide is C[N+]1(CC(=O)NN)CC[N+](C)(CC(=O)NN)CC1.
What is the InChIKey of 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide?
The InChIKey is LDKJMXOGALTIGE-UHFFFAOYSA-P. The full InChI is InChI=1S/C10H22N6O2/c1-15(7-9(17)13-11)3-5-16(2,6-4-15)8-10(18)14-12/h3-8,11-12H2,1-2H3/p+2.
What are the key properties of 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide?
2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide has a molecular weight of 260.34 g/mol, XLogP of -3.13, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-hydrazinyl-2-oxoethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]acetohydrazide is sourced from PubChem (CID 129104105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).