[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine

C16H28N4O — CID 81001432

IUPAC[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine
SMILESCCCc1nc(NN)c(C)c(OC2CCCC(CC)C2)n1
InChIInChI=1S/C16H28N4O/c1-4-7-14-18-15(20-17)11(3)16(19-14)21-13-9-6-8-12(5-2)10-13/h12-13H,4-10,17H2,1-3H3,(H,18,19,20)
InChIKeyZHFUUKLWZAFZSG-UHFFFAOYSA-N
MW292.43 g/mol
LogP3.37
Rot. Bonds6

About [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine

[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine (PubChem CID 81001432) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine
PubChem CID81001432
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine
SMILESCCCc1nc(NN)c(C)c(OC2CCCC(CC)C2)n1
InChIInChI=1S/C16H28N4O/c1-4-7-14-18-15(20-17)11(3)16(19-14)21-13-9-6-8-12(5-2)10-13/h12-13H,4-10,17H2,1-3H3,(H,18,19,20)
InChIKeyZHFUUKLWZAFZSG-UHFFFAOYSA-N
XLogP3.37
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 53.37
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 [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine (CID 81001432) is [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine is CCCc1nc(NN)c(C)c(OC2CCCC(CC)C2)n1.
What is the InChIKey of [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine?
The InChIKey is ZHFUUKLWZAFZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-4-7-14-18-15(20-17)11(3)16(19-14)21-13-9-6-8-12(5-2)10-13/h12-13H,4-10,17H2,1-3H3,(H,18,19,20).
What are the key properties of [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine?
[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine has a molecular weight of 292.43 g/mol, XLogP of 3.37, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 81001432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).