[6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine

C13H23N5O — CID 80905523

IUPAC[6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine
SMILESCCOC1CCCN(c2ncnc(NN)c2CC)C1
InChIInChI=1S/C13H23N5O/c1-3-11-12(17-14)15-9-16-13(11)18-7-5-6-10(8-18)19-4-2/h9-10H,3-8,14H2,1-2H3,(H,15,16,17)
InChIKeyJDGOMSCAZZTFKD-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.33
Rot. Bonds5

About [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine

[6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine (PubChem CID 80905523) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine
PubChem CID80905523
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name[6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine
SMILESCCOC1CCCN(c2ncnc(NN)c2CC)C1
InChIInChI=1S/C13H23N5O/c1-3-11-12(17-14)15-9-16-13(11)18-7-5-6-10(8-18)19-4-2/h9-10H,3-8,14H2,1-2H3,(H,15,16,17)
InChIKeyJDGOMSCAZZTFKD-UHFFFAOYSA-N
XLogP1.33
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.33
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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Related Compounds

[6-(3-ethoxypiperidin-1-yl)pyrimidin-4-yl]hydrazine
CID 80905232
[6-(3-ethoxypiperidin-1-yl)-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80905049
[5-ethyl-6-(1,4-thiazepan-4-yl)pyrimidin-4-yl]hydrazine
CID 80896615
[6-(4-ethoxypiperidin-1-yl)-5-methylpyrimidin-4-yl]hydrazine
CID 80898594
[6-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-5-propylpyrimidin-4-yl]hydrazine
CID 80904341
6-(3-ethoxypiperidin-1-yl)-5-nitropyrimidin-4-amine
CID 80806123
[6-(2-azabicyclo[2.2.1]heptan-2-yl)-5-ethylpyrimidin-4-yl]hydrazine
CID 80905027
[3-(3-ethoxypiperidin-1-yl)pyrazin-2-yl]methanamine
CID 62673049
[5-ethyl-6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)pyrimidin-4-yl]hydrazine
CID 80905373
[5-ethyl-6-(2-methylazepan-1-yl)pyrimidin-4-yl]hydrazine
CID 80911682
4-(3-ethoxypiperidin-1-yl)-6-fluoroquinazoline
CID 133274317
[6-(4-methoxypiperidin-1-yl)-5-propylpyrimidin-4-yl]hydrazine
CID 80894834

Frequently Asked Questions

What is the IUPAC name of [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine (CID 80905523) is [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine is CCOC1CCCN(c2ncnc(NN)c2CC)C1.
What is the InChIKey of [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine?
The InChIKey is JDGOMSCAZZTFKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-3-11-12(17-14)15-9-16-13(11)18-7-5-6-10(8-18)19-4-2/h9-10H,3-8,14H2,1-2H3,(H,15,16,17).
What are the key properties of [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine?
[6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine has a molecular weight of 265.36 g/mol, XLogP of 1.33, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-ethoxypiperidin-1-yl)-5-ethylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80905523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).