[1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine

C12H22N4O — CID 105256099

IUPAC[1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCn1ccc(CC(NN)C2(C)CCCCO2)n1
InChIInChI=1S/C12H22N4O/c1-12(6-3-4-8-17-12)11(14-13)9-10-5-7-16(2)15-10/h5,7,11,14H,3-4,6,8-9,13H2,1-2H3
InChIKeyGFOONTKMDRCAEP-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.75
Rot. Bonds4

About [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine

[1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105256099) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105256099
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name[1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCn1ccc(CC(NN)C2(C)CCCCO2)n1
InChIInChI=1S/C12H22N4O/c1-12(6-3-4-8-17-12)11(14-13)9-10-5-7-16(2)15-10/h5,7,11,14H,3-4,6,8-9,13H2,1-2H3
InChIKeyGFOONTKMDRCAEP-UHFFFAOYSA-N
XLogP0.75
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 ≤ 50.75
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-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine (CID 105256099) is [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine is Cn1ccc(CC(NN)C2(C)CCCCO2)n1.
What is the InChIKey of [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is GFOONTKMDRCAEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-12(6-3-4-8-17-12)11(14-13)9-10-5-7-16(2)15-10/h5,7,11,14H,3-4,6,8-9,13H2,1-2H3.
What are the key properties of [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine?
[1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 238.33 g/mol, XLogP of 0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methyloxan-2-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105256099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).