[4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine

C12H21N5 — CID 80895681

IUPAC[4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine
SMILESCCC1CCN(c2cc(C)nc(NN)n2)CC1
InChIInChI=1S/C12H21N5/c1-3-10-4-6-17(7-5-10)11-8-9(2)14-12(15-11)16-13/h8,10H,3-7,13H2,1-2H3,(H,14,15,16)
InChIKeyFQIJTWJJKAAMBA-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.70
Rot. Bonds3

About [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine

[4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine (PubChem CID 80895681) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine
PubChem CID80895681
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name[4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine
SMILESCCC1CCN(c2cc(C)nc(NN)n2)CC1
InChIInChI=1S/C12H21N5/c1-3-10-4-6-17(7-5-10)11-8-9(2)14-12(15-11)16-13/h8,10H,3-7,13H2,1-2H3,(H,14,15,16)
InChIKeyFQIJTWJJKAAMBA-UHFFFAOYSA-N
XLogP1.70
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.70
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'}

Analyze [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine (CID 80895681) is [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine is CCC1CCN(c2cc(C)nc(NN)n2)CC1.
What is the InChIKey of [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine?
The InChIKey is FQIJTWJJKAAMBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-3-10-4-6-17(7-5-10)11-8-9(2)14-12(15-11)16-13/h8,10H,3-7,13H2,1-2H3,(H,14,15,16).
What are the key properties of [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine?
[4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine has a molecular weight of 235.33 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-ethylpiperidin-1-yl)-6-methylpyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80895681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).