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

C10H13ClN6 — CID 80968945

IUPAC[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCC(C)c1nc(NN)cc(-n2cc(Cl)cn2)n1
InChIInChI=1S/C10H13ClN6/c1-6(2)10-14-8(16-12)3-9(15-10)17-5-7(11)4-13-17/h3-6H,12H2,1-2H3,(H,14,15,16)
InChIKeyCMAKWDJREKYCCG-UHFFFAOYSA-N
MW252.71 g/mol
LogP1.72
Rot. Bonds3

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

[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 80968945) has the molecular formula C10H13ClN6 and a molecular weight of 252.71 g/mol. Its IUPAC name is [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID80968945
Molecular FormulaC10H13ClN6
Molecular Weight252.71 g/mol
Exact Mass252.09
IUPAC Name[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCC(C)c1nc(NN)cc(-n2cc(Cl)cn2)n1
InChIInChI=1S/C10H13ClN6/c1-6(2)10-14-8(16-12)3-9(15-10)17-5-7(11)4-13-17/h3-6H,12H2,1-2H3,(H,14,15,16)
InChIKeyCMAKWDJREKYCCG-UHFFFAOYSA-N
XLogP1.72
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.71
LogP ≤ 51.72
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'}

Analyze [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-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 [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine (CID 80968945) is [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine is CC(C)c1nc(NN)cc(-n2cc(Cl)cn2)n1.
What is the InChIKey of [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is CMAKWDJREKYCCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN6/c1-6(2)10-14-8(16-12)3-9(15-10)17-5-7(11)4-13-17/h3-6H,12H2,1-2H3,(H,14,15,16).
What are the key properties of [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine?
[6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 252.71 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-chloropyrazol-1-yl)-2-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80968945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).