[6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine

C13H20N6O — CID 81346637

IUPAC[6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1cc(Oc2nc(C(C)C)nc(NN)c2C)n(C)n1
InChIInChI=1S/C13H20N6O/c1-7(2)11-15-12(17-14)9(4)13(16-11)20-10-6-8(3)18-19(10)5/h6-7H,14H2,1-5H3,(H,15,16,17)
InChIKeyHXAYNMBZZPSZHX-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.03
Rot. Bonds4

About [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine

[6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 81346637) has the molecular formula C13H20N6O and a molecular weight of 276.34 g/mol. Its IUPAC name is [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID81346637
Molecular FormulaC13H20N6O
Molecular Weight276.34 g/mol
Exact Mass276.17
IUPAC Name[6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1cc(Oc2nc(C(C)C)nc(NN)c2C)n(C)n1
InChIInChI=1S/C13H20N6O/c1-7(2)11-15-12(17-14)9(4)13(16-11)20-10-6-8(3)18-19(10)5/h6-7H,14H2,1-5H3,(H,15,16,17)
InChIKeyHXAYNMBZZPSZHX-UHFFFAOYSA-N
XLogP2.03
TPSA90.88 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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 [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine (CID 81346637) is [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine is Cc1cc(Oc2nc(C(C)C)nc(NN)c2C)n(C)n1.
What is the InChIKey of [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is HXAYNMBZZPSZHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6O/c1-7(2)11-15-12(17-14)9(4)13(16-11)20-10-6-8(3)18-19(10)5/h6-7H,14H2,1-5H3,(H,15,16,17).
What are the key properties of [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 276.34 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,5-dimethylpyrazol-3-yl)oxy-5-methyl-2-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 81346637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).