N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide

C13H26N4O — CID 138527020

IUPACN-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide
SMILESNN(CCN1CCNCC1)C(=O)C1CCCCC1
InChIInChI=1S/C13H26N4O/c14-17(11-10-16-8-6-15-7-9-16)13(18)12-4-2-1-3-5-12/h12,15H,1-11,14H2
InChIKeyGUQZVWUKVUDOHA-UHFFFAOYSA-N
MW254.38 g/mol
LogP0.17
Rot. Bonds4

About N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide

N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide (PubChem CID 138527020) has the molecular formula C13H26N4O and a molecular weight of 254.38 g/mol. Its IUPAC name is N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide.

Molecular Properties

Compound NameN-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide
PubChem CID138527020
Molecular FormulaC13H26N4O
Molecular Weight254.38 g/mol
Exact Mass254.21
IUPAC NameN-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide
SMILESNN(CCN1CCNCC1)C(=O)C1CCCCC1
InChIInChI=1S/C13H26N4O/c14-17(11-10-16-8-6-15-7-9-16)13(18)12-4-2-1-3-5-12/h12,15H,1-11,14H2
InChIKeyGUQZVWUKVUDOHA-UHFFFAOYSA-N
XLogP0.17
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 50.17
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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Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide?
The IUPAC name of N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide (CID 138527020) is N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide.
What is the SMILES notation for N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide?
The canonical SMILES for N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide is NN(CCN1CCNCC1)C(=O)C1CCCCC1.
What is the InChIKey of N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide?
The InChIKey is GUQZVWUKVUDOHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O/c14-17(11-10-16-8-6-15-7-9-16)13(18)12-4-2-1-3-5-12/h12,15H,1-11,14H2.
What are the key properties of N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide?
N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide has a molecular weight of 254.38 g/mol, XLogP of 0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperazin-1-ylethyl)cyclohexanecarbohydrazide is sourced from PubChem (CID 138527020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).