[1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine

C13H24N4 — CID 105335883

IUPAC[1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)c1cc(CC)nn1CC
InChIInChI=1S/C13H24N4/c1-5-11-9-13(17(6-2)16-11)12(15-14)8-7-10(3)4/h9,12,15H,3,5-8,14H2,1-2,4H3
InChIKeyLJVXACTVKJBJDI-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.33
Rot. Bonds7

About [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine

[1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine (PubChem CID 105335883) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine.

Molecular Properties

Compound Name[1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine
PubChem CID105335883
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name[1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)c1cc(CC)nn1CC
InChIInChI=1S/C13H24N4/c1-5-11-9-13(17(6-2)16-11)12(15-14)8-7-10(3)4/h9,12,15H,3,5-8,14H2,1-2,4H3
InChIKeyLJVXACTVKJBJDI-UHFFFAOYSA-N
XLogP2.33
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(1,3-diethylpyrazol-5-yl)prop-2-enylhydrazine
CID 105318016
[1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105318519
[1-(1,3-diethylpyrazol-5-yl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105291835
[1-(1,3-diethylpyrazol-5-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314095
[1-(1,3-diethylpyrazol-5-yl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105377996
[1-(1,3-diethylpyrazol-5-yl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105324386
[1-(3-ethyl-1-methylpyrazol-5-yl)-2-methylprop-2-enyl]hydrazine
CID 105320009
1-(1,3-diethylpyrazol-5-yl)-5,5,5-trifluoro-N-propylpentan-1-amine
CID 105174359
[2-(1,3-diethylpyrazol-5-yl)-1-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 105318310
1,3-diethyl-5-propan-2-ylpyrazole
CID 118564106
1-(1,3-diethylpyrazol-5-yl)-N,3-dimethylbutan-1-amine
CID 105082907
1-(1,3-diethylpyrazol-5-yl)-N-ethylbut-3-en-1-amine
CID 105108095

Frequently Asked Questions

What is the IUPAC name of [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine?
The IUPAC name of [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine (CID 105335883) is [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine.
What is the SMILES notation for [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine?
The canonical SMILES for [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine is C=C(C)CCC(NN)c1cc(CC)nn1CC.
What is the InChIKey of [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine?
The InChIKey is LJVXACTVKJBJDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-5-11-9-13(17(6-2)16-11)12(15-14)8-7-10(3)4/h9,12,15H,3,5-8,14H2,1-2,4H3.
What are the key properties of [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine?
[1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine has a molecular weight of 236.36 g/mol, XLogP of 2.33, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-diethylpyrazol-5-yl)-4-methylpent-4-enyl]hydrazine is sourced from PubChem (CID 105335883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).