[2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine

C13H24N4O — CID 116730346

IUPAC[2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCCOC(c1nc(NN)cc(C(C)C)n1)C(C)C
InChIInChI=1S/C13H24N4O/c1-6-18-12(9(4)5)13-15-10(8(2)3)7-11(16-13)17-14/h7-9,12H,6,14H2,1-5H3,(H,15,16,17)
InChIKeySUELWRRGZSILSJ-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.62
Rot. Bonds6

About [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine

[2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 116730346) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID116730346
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name[2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCCOC(c1nc(NN)cc(C(C)C)n1)C(C)C
InChIInChI=1S/C13H24N4O/c1-6-18-12(9(4)5)13-15-10(8(2)3)7-11(16-13)17-14/h7-9,12H,6,14H2,1-5H3,(H,15,16,17)
InChIKeySUELWRRGZSILSJ-UHFFFAOYSA-N
XLogP2.62
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.62
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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Related Compounds

[2-[cyclohexyl(ethoxy)methyl]-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 116777584
[2-(2-ethoxypropan-2-yl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
CID 116730343
(2-butyl-6-propan-2-ylpyrimidin-4-yl)hydrazine
CID 79413063
[6-(methoxymethyl)-2-(1-methoxy-2-methylpropyl)pyrimidin-4-yl]hydrazine
CID 116730396
[2-(1-ethoxy-2-methylpropyl)-6-ethylthieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 116730245
N-ethyl-2,6-di(propan-2-yl)pyrimidin-4-amine
CID 62191637
2-(1-ethoxy-2-methylpropyl)-N-methylpyrimidin-4-amine
CID 116728964
(6-butan-2-yloxy-2-propan-2-ylpyrimidin-4-yl)hydrazine
CID 80969257
[2-(1-ethoxybutyl)-6-propylpyrimidin-4-yl]hydrazine
CID 116730310
[2-(1-ethoxy-2-methylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 116730268
2-[2-(1-ethoxy-2-methylpropyl)-6-methylpyrimidin-4-yl]ethanamine
CID 116731486
N-(1-ethoxypropan-2-yl)-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80964267

Frequently Asked Questions

What is the IUPAC name of [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine (CID 116730346) is [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine is CCOC(c1nc(NN)cc(C(C)C)n1)C(C)C.
What is the InChIKey of [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is SUELWRRGZSILSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-6-18-12(9(4)5)13-15-10(8(2)3)7-11(16-13)17-14/h7-9,12H,6,14H2,1-5H3,(H,15,16,17).
What are the key properties of [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
[2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 252.36 g/mol, XLogP of 2.62, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-ethoxy-2-methylpropyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 116730346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).