[2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine

C14H22N6O — CID 116806890

IUPAC[2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
SMILESCCCn1cc(Oc2cc(NN)nc(C(C)(C)C)n2)cn1
InChIInChI=1S/C14H22N6O/c1-5-6-20-9-10(8-16-20)21-12-7-11(19-15)17-13(18-12)14(2,3)4/h7-9H,5-6,15H2,1-4H3,(H,17,18,19)
InChIKeyGIWHNEWAVMDJSO-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.46
Rot. Bonds5

About [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine

[2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine (PubChem CID 116806890) has the molecular formula C14H22N6O and a molecular weight of 290.37 g/mol. Its IUPAC name is [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
PubChem CID116806890
Molecular FormulaC14H22N6O
Molecular Weight290.37 g/mol
Exact Mass290.19
IUPAC Name[2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
SMILESCCCn1cc(Oc2cc(NN)nc(C(C)(C)C)n2)cn1
InChIInChI=1S/C14H22N6O/c1-5-6-20-9-10(8-16-20)21-12-7-11(19-15)17-13(18-12)14(2,3)4/h7-9H,5-6,15H2,1-4H3,(H,17,18,19)
InChIKeyGIWHNEWAVMDJSO-UHFFFAOYSA-N
XLogP2.46
TPSA90.88 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.46
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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Related Compounds

N-methyl-6-(1-propylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774804
[2-ethyl-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 116794584
(2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine
CID 80968739
[2-tert-butyl-6-(4-chlorophenoxy)pyrimidin-4-yl]hydrazine
CID 80968447
[6-(1-propan-2-ylpyrazol-4-yl)oxy-2-(trifluoromethyl)pyrimidin-4-yl]hydrazine
CID 106776489
2-tert-butyl-6-(1-methylpyrazol-4-yl)oxypyrimidin-4-amine
CID 116794520
[2-tert-butyl-6-(3-fluorophenoxy)pyrimidin-4-yl]hydrazine
CID 80979164
6-(1-ethylpyrazol-4-yl)oxy-4-N-propylpyrimidine-2,4-diamine
CID 116805934
[2-tert-butyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]hydrazine
CID 80968204
2-(1-propylpyrazol-4-yl)oxypyridin-4-amine
CID 116800439
[2-tert-butyl-6-(2-ethoxyethoxy)pyrimidin-4-yl]hydrazine
CID 80968844
3,5-dichloro-N-ethyl-6-(1-propylpyrazol-4-yl)oxypyridin-2-amine
CID 102761179

Frequently Asked Questions

What is the IUPAC name of [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine?
The IUPAC name of [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine (CID 116806890) is [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine is CCCn1cc(Oc2cc(NN)nc(C(C)(C)C)n2)cn1.
What is the InChIKey of [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine?
The InChIKey is GIWHNEWAVMDJSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O/c1-5-6-20-9-10(8-16-20)21-12-7-11(19-15)17-13(18-12)14(2,3)4/h7-9H,5-6,15H2,1-4H3,(H,17,18,19).
What are the key properties of [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine?
[2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine has a molecular weight of 290.37 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-tert-butyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine is sourced from PubChem (CID 116806890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).