2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone

C12H26N4O — CID 168749112

IUPAC2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone
SMILESCC(C)CCCN1CCN(C(=O)CNN)CC1
InChIInChI=1S/C12H26N4O/c1-11(2)4-3-5-15-6-8-16(9-7-15)12(17)10-14-13/h11,14H,3-10,13H2,1-2H3
InChIKeyWWHGZKPMOWKFHW-UHFFFAOYSA-N
MW242.37 g/mol
LogP0.03
Rot. Bonds6

About 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone

2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone (PubChem CID 168749112) has the molecular formula C12H26N4O and a molecular weight of 242.37 g/mol. Its IUPAC name is 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone
PubChem CID168749112
Molecular FormulaC12H26N4O
Molecular Weight242.37 g/mol
Exact Mass242.21
IUPAC Name2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone
SMILESCC(C)CCCN1CCN(C(=O)CNN)CC1
InChIInChI=1S/C12H26N4O/c1-11(2)4-3-5-15-6-8-16(9-7-15)12(17)10-14-13/h11,14H,3-10,13H2,1-2H3
InChIKeyWWHGZKPMOWKFHW-UHFFFAOYSA-N
XLogP0.03
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone?
The IUPAC name of 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone (CID 168749112) is 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone.
What is the SMILES notation for 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone?
The canonical SMILES for 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone is CC(C)CCCN1CCN(C(=O)CNN)CC1.
What is the InChIKey of 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone?
The InChIKey is WWHGZKPMOWKFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4O/c1-11(2)4-3-5-15-6-8-16(9-7-15)12(17)10-14-13/h11,14H,3-10,13H2,1-2H3.
What are the key properties of 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone?
2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone has a molecular weight of 242.37 g/mol, XLogP of 0.03, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-1-[4-(4-methylpentyl)piperazin-1-yl]ethanone is sourced from PubChem (CID 168749112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).