[2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine

C14H26N4O — CID 116777670

IUPAC[2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCCC(CC)(OC)c1nc(C)c(C(C)C)c(NN)n1
InChIInChI=1S/C14H26N4O/c1-7-14(8-2,19-6)13-16-10(5)11(9(3)4)12(17-13)18-15/h9H,7-8,15H2,1-6H3,(H,16,17,18)
InChIKeyGBEQDXZMZOMNGY-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.86
Rot. Bonds6

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

[2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 116777670) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID116777670
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name[2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCCC(CC)(OC)c1nc(C)c(C(C)C)c(NN)n1
InChIInChI=1S/C14H26N4O/c1-7-14(8-2,19-6)13-16-10(5)11(9(3)4)12(17-13)18-15/h9H,7-8,15H2,1-6H3,(H,16,17,18)
InChIKeyGBEQDXZMZOMNGY-UHFFFAOYSA-N
XLogP2.86
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.86
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 [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine (CID 116777670) is [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine is CCC(CC)(OC)c1nc(C)c(C(C)C)c(NN)n1.
What is the InChIKey of [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is GBEQDXZMZOMNGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-7-14(8-2,19-6)13-16-10(5)11(9(3)4)12(17-13)18-15/h9H,7-8,15H2,1-6H3,(H,16,17,18).
What are the key properties of [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine?
[2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 266.39 g/mol, XLogP of 2.86, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methoxypentan-3-yl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 116777670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).