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

C16H30N4O — CID 105318400

IUPAC[2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
SMILESCCc1cc(CC(NN)C2C(C)OC(C)C2C)n(CC)n1
InChIInChI=1S/C16H30N4O/c1-6-13-8-14(20(7-2)19-13)9-15(18-17)16-10(3)11(4)21-12(16)5/h8,10-12,15-16,18H,6-7,9,17H2,1-5H3
InChIKeyZSFNAWWJYUXMDZ-UHFFFAOYSA-N
MW294.44 g/mol
LogP1.90
Rot. Bonds6

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

[2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine (PubChem CID 105318400) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
PubChem CID105318400
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC Name[2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
SMILESCCc1cc(CC(NN)C2C(C)OC(C)C2C)n(CC)n1
InChIInChI=1S/C16H30N4O/c1-6-13-8-14(20(7-2)19-13)9-15(18-17)16-10(3)11(4)21-12(16)5/h8,10-12,15-16,18H,6-7,9,17H2,1-5H3
InChIKeyZSFNAWWJYUXMDZ-UHFFFAOYSA-N
XLogP1.90
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine (CID 105318400) is [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine is CCc1cc(CC(NN)C2C(C)OC(C)C2C)n(CC)n1.
What is the InChIKey of [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine?
The InChIKey is ZSFNAWWJYUXMDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-6-13-8-14(20(7-2)19-13)9-15(18-17)16-10(3)11(4)21-12(16)5/h8,10-12,15-16,18H,6-7,9,17H2,1-5H3.
What are the key properties of [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine?
[2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine has a molecular weight of 294.44 g/mol, XLogP of 1.90, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1,3-diethylpyrazol-5-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105318400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).