1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine

C11H24N4 — CID 105249829

IUPAC1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine
SMILESCCCCC(NN)C1CN2CCN1CC2
InChIInChI=1S/C11H24N4/c1-2-3-4-10(13-12)11-9-14-5-7-15(11)8-6-14/h10-11,13H,2-9,12H2,1H3
InChIKeyKAPPLBHRLCJGLF-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.01
Rot. Bonds5

About 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine

1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine (PubChem CID 105249829) has the molecular formula C11H24N4 and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine.

Molecular Properties

Compound Name1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine
PubChem CID105249829
Molecular FormulaC11H24N4
Molecular Weight212.34 g/mol
Exact Mass212.20
IUPAC Name1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine
SMILESCCCCC(NN)C1CN2CCN1CC2
InChIInChI=1S/C11H24N4/c1-2-3-4-10(13-12)11-9-14-5-7-15(11)8-6-14/h10-11,13H,2-9,12H2,1H3
InChIKeyKAPPLBHRLCJGLF-UHFFFAOYSA-N
XLogP0.01
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.01
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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Related Compounds

[1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-5,5,5-trifluoropentyl]hydrazine
CID 105249934
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)hex-5-enylhydrazine
CID 105249868
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-N-ethylnonan-1-amine
CID 79973836
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)oct-7-enylhydrazine
CID 107012569
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pent-4-ynylhydrazine
CID 105249960
[1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-2-(4-ethylphenyl)ethyl]hydrazine
CID 105249842
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-N-ethylbutan-1-amine
CID 79973669
1-cyclopropylpentylhydrazine
CID 105202332
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-N-ethyl-5-methylhexan-1-amine
CID 83162240
1-(1,4-dimethyl-1,4-diazepan-2-yl)pentylhydrazine
CID 105261145
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)butan-1-amine
CID 79969201
1-(3-bicyclo[3.1.0]hexanyl)pentylhydrazine
CID 105293745

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine?
The IUPAC name of 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine (CID 105249829) is 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine.
What is the SMILES notation for 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine?
The canonical SMILES for 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine is CCCCC(NN)C1CN2CCN1CC2.
What is the InChIKey of 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine?
The InChIKey is KAPPLBHRLCJGLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4/c1-2-3-4-10(13-12)11-9-14-5-7-15(11)8-6-14/h10-11,13H,2-9,12H2,1H3.
What are the key properties of 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine?
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine has a molecular weight of 212.34 g/mol, XLogP of 0.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-diazabicyclo[2.2.2]octan-2-yl)pentylhydrazine is sourced from PubChem (CID 105249829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).