[4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine

C11H15N7O2 — CID 80913159

IUPAC[4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
SMILESNNc1nc(OCC2CCCO2)nc(-n2cccn2)n1
InChIInChI=1S/C11H15N7O2/c12-17-9-14-10(18-5-2-4-13-18)16-11(15-9)20-7-8-3-1-6-19-8/h2,4-5,8H,1,3,6-7,12H2,(H,14,15,16,17)
InChIKeyPZGHWRFHPUOZBH-UHFFFAOYSA-N
MW277.29 g/mol
LogP-0.10
Rot. Bonds5

About [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine

[4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine (PubChem CID 80913159) has the molecular formula C11H15N7O2 and a molecular weight of 277.29 g/mol. Its IUPAC name is [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
PubChem CID80913159
Molecular FormulaC11H15N7O2
Molecular Weight277.29 g/mol
Exact Mass277.13
IUPAC Name[4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine
SMILESNNc1nc(OCC2CCCO2)nc(-n2cccn2)n1
InChIInChI=1S/C11H15N7O2/c12-17-9-14-10(18-5-2-4-13-18)16-11(15-9)20-7-8-3-1-6-19-8/h2,4-5,8H,1,3,6-7,12H2,(H,14,15,16,17)
InChIKeyPZGHWRFHPUOZBH-UHFFFAOYSA-N
XLogP-0.10
TPSA113.00 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.29
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine (CID 80913159) is [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine is NNc1nc(OCC2CCCO2)nc(-n2cccn2)n1.
What is the InChIKey of [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is PZGHWRFHPUOZBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O2/c12-17-9-14-10(18-5-2-4-13-18)16-11(15-9)20-7-8-3-1-6-19-8/h2,4-5,8H,1,3,6-7,12H2,(H,14,15,16,17).
What are the key properties of [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine?
[4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 277.29 g/mol, XLogP of -0.10, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(oxolan-2-ylmethoxy)-6-pyrazol-1-yl-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 80913159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).