[6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine

C12H20N4O2 — CID 80925248

IUPAC[6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine
SMILESCOC1CCCC(Oc2cc(NN)nc(C)n2)C1
InChIInChI=1S/C12H20N4O2/c1-8-14-11(16-13)7-12(15-8)18-10-5-3-4-9(6-10)17-2/h7,9-10H,3-6,13H2,1-2H3,(H,14,15,16)
InChIKeySDGOJLIHKOLYNF-UHFFFAOYSA-N
MW252.32 g/mol
LogP1.41
Rot. Bonds4

About [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine

[6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine (PubChem CID 80925248) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine
PubChem CID80925248
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name[6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine
SMILESCOC1CCCC(Oc2cc(NN)nc(C)n2)C1
InChIInChI=1S/C12H20N4O2/c1-8-14-11(16-13)7-12(15-8)18-10-5-3-4-9(6-10)17-2/h7,9-10H,3-6,13H2,1-2H3,(H,14,15,16)
InChIKeySDGOJLIHKOLYNF-UHFFFAOYSA-N
XLogP1.41
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine (CID 80925248) is [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine is COC1CCCC(Oc2cc(NN)nc(C)n2)C1.
What is the InChIKey of [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine?
The InChIKey is SDGOJLIHKOLYNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-8-14-11(16-13)7-12(15-8)18-10-5-3-4-9(6-10)17-2/h7,9-10H,3-6,13H2,1-2H3,(H,14,15,16).
What are the key properties of [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine?
[6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine has a molecular weight of 252.32 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-methoxycyclohexyl)oxy-2-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80925248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).