(2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine

C10H18N4O — CID 80968739

IUPAC(2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine
SMILESCCOc1cc(NN)nc(C(C)(C)C)n1
InChIInChI=1S/C10H18N4O/c1-5-15-8-6-7(14-11)12-9(13-8)10(2,3)4/h6H,5,11H2,1-4H3,(H,12,13,14)
InChIKeyLTGUSXBHHBEMLL-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.46
Rot. Bonds3

About (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine

(2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine (PubChem CID 80968739) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine
PubChem CID80968739
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name(2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine
SMILESCCOc1cc(NN)nc(C(C)(C)C)n1
InChIInChI=1S/C10H18N4O/c1-5-15-8-6-7(14-11)12-9(13-8)10(2,3)4/h6H,5,11H2,1-4H3,(H,12,13,14)
InChIKeyLTGUSXBHHBEMLL-UHFFFAOYSA-N
XLogP1.46
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.46
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-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine?
The IUPAC name of (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine (CID 80968739) is (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine.
What is the SMILES notation for (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine?
The canonical SMILES for (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine is CCOc1cc(NN)nc(C(C)(C)C)n1.
What is the InChIKey of (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine?
The InChIKey is LTGUSXBHHBEMLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-5-15-8-6-7(14-11)12-9(13-8)10(2,3)4/h6H,5,11H2,1-4H3,(H,12,13,14).
What are the key properties of (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine?
(2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine has a molecular weight of 210.28 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-tert-butyl-6-ethoxypyrimidin-4-yl)hydrazine is sourced from PubChem (CID 80968739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).