[1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine

C12H22N4O — CID 105306650

IUPAC[1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
SMILESCc1nn(C)c(C)c1CC(NN)C1CCOC1
InChIInChI=1S/C12H22N4O/c1-8-11(9(2)16(3)15-8)6-12(14-13)10-4-5-17-7-10/h10,12,14H,4-7,13H2,1-3H3
InChIKeySPSZNKUUGIXYAY-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.45
Rot. Bonds4

About [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine

[1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 105306650) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
PubChem CID105306650
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name[1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
SMILESCc1nn(C)c(C)c1CC(NN)C1CCOC1
InChIInChI=1S/C12H22N4O/c1-8-11(9(2)16(3)15-8)6-12(14-13)10-4-5-17-7-10/h10,12,14H,4-7,13H2,1-3H3
InChIKeySPSZNKUUGIXYAY-UHFFFAOYSA-N
XLogP0.45
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.45
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 [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine (CID 105306650) is [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine is Cc1nn(C)c(C)c1CC(NN)C1CCOC1.
What is the InChIKey of [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is SPSZNKUUGIXYAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-8-11(9(2)16(3)15-8)6-12(14-13)10-4-5-17-7-10/h10,12,14H,4-7,13H2,1-3H3.
What are the key properties of [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine?
[1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 238.33 g/mol, XLogP of 0.45, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105306650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).