[1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine

C13H23N7 — CID 105318519

IUPAC[1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine
SMILESCCc1cc(C(Cc2ncnn2CC)NN)n(CC)n1
InChIInChI=1S/C13H23N7/c1-4-10-7-12(19(5-2)18-10)11(17-14)8-13-15-9-16-20(13)6-3/h7,9,11,17H,4-6,8,14H2,1-3H3
InChIKeyKRXIFXHLEBZRHH-UHFFFAOYSA-N
MW277.38 g/mol
LogP0.82
Rot. Bonds7

About [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine

[1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine (PubChem CID 105318519) has the molecular formula C13H23N7 and a molecular weight of 277.38 g/mol. Its IUPAC name is [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine
PubChem CID105318519
Molecular FormulaC13H23N7
Molecular Weight277.38 g/mol
Exact Mass277.20
IUPAC Name[1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine
SMILESCCc1cc(C(Cc2ncnn2CC)NN)n(CC)n1
InChIInChI=1S/C13H23N7/c1-4-10-7-12(19(5-2)18-10)11(17-14)8-13-15-9-16-20(13)6-3/h7,9,11,17H,4-6,8,14H2,1-3H3
InChIKeyKRXIFXHLEBZRHH-UHFFFAOYSA-N
XLogP0.82
TPSA86.58 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.38
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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 [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine (CID 105318519) is [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine is CCc1cc(C(Cc2ncnn2CC)NN)n(CC)n1.
What is the InChIKey of [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine?
The InChIKey is KRXIFXHLEBZRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N7/c1-4-10-7-12(19(5-2)18-10)11(17-14)8-13-15-9-16-20(13)6-3/h7,9,11,17H,4-6,8,14H2,1-3H3.
What are the key properties of [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine?
[1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine has a molecular weight of 277.38 g/mol, XLogP of 0.82, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-diethylpyrazol-5-yl)-2-(2-ethyl-1,2,4-triazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105318519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).