4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine

C11H19N7 — CID 105231039

IUPAC4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
SMILESCCn1nc(C)cc1CC(NN)c1cn[nH]c1N
InChIInChI=1S/C11H19N7/c1-3-18-8(4-7(2)17-18)5-10(15-13)9-6-14-16-11(9)12/h4,6,10,15H,3,5,13H2,1-2H3,(H3,12,14,16)
InChIKeyPZAXDYPRSSMXHF-UHFFFAOYSA-N
MW249.32 g/mol
LogP0.26
Rot. Bonds5

About 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine

4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine (PubChem CID 105231039) has the molecular formula C11H19N7 and a molecular weight of 249.32 g/mol. Its IUPAC name is 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
PubChem CID105231039
Molecular FormulaC11H19N7
Molecular Weight249.32 g/mol
Exact Mass249.17
IUPAC Name4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
SMILESCCn1nc(C)cc1CC(NN)c1cn[nH]c1N
InChIInChI=1S/C11H19N7/c1-3-18-8(4-7(2)17-18)5-10(15-13)9-6-14-16-11(9)12/h4,6,10,15H,3,5,13H2,1-2H3,(H3,12,14,16)
InChIKeyPZAXDYPRSSMXHF-UHFFFAOYSA-N
XLogP0.26
TPSA110.57 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 50.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The IUPAC name of 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine (CID 105231039) is 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine.
What is the SMILES notation for 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The canonical SMILES for 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine is CCn1nc(C)cc1CC(NN)c1cn[nH]c1N.
What is the InChIKey of 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The InChIKey is PZAXDYPRSSMXHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N7/c1-3-18-8(4-7(2)17-18)5-10(15-13)9-6-14-16-11(9)12/h4,6,10,15H,3,5,13H2,1-2H3,(H3,12,14,16).
What are the key properties of 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine has a molecular weight of 249.32 g/mol, XLogP of 0.26, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine is sourced from PubChem (CID 105231039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).