[3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine

C12H22N4O — CID 103026246

IUPAC[3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine
SMILESCn1nccc1CCC(NN)C1CCCOC1
InChIInChI=1S/C12H22N4O/c1-16-11(6-7-14-16)4-5-12(15-13)10-3-2-8-17-9-10/h6-7,10,12,15H,2-5,8-9,13H2,1H3
InChIKeyASPFMHUNGZGYAY-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.61
Rot. Bonds5

About [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine

[3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine (PubChem CID 103026246) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine.

Molecular Properties

Compound Name[3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine
PubChem CID103026246
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name[3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine
SMILESCn1nccc1CCC(NN)C1CCCOC1
InChIInChI=1S/C12H22N4O/c1-16-11(6-7-14-16)4-5-12(15-13)10-3-2-8-17-9-10/h6-7,10,12,15H,2-5,8-9,13H2,1H3
InChIKeyASPFMHUNGZGYAY-UHFFFAOYSA-N
XLogP0.61
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.61
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 [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine?
The IUPAC name of [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine (CID 103026246) is [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine.
What is the SMILES notation for [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine?
The canonical SMILES for [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine is Cn1nccc1CCC(NN)C1CCCOC1.
What is the InChIKey of [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine?
The InChIKey is ASPFMHUNGZGYAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-16-11(6-7-14-16)4-5-12(15-13)10-3-2-8-17-9-10/h6-7,10,12,15H,2-5,8-9,13H2,1H3.
What are the key properties of [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine?
[3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine has a molecular weight of 238.33 g/mol, XLogP of 0.61, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methylpyrazol-3-yl)-1-(oxan-3-yl)propyl]hydrazine is sourced from PubChem (CID 103026246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).