[2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine

C9H15FN6 — CID 150851390

IUPAC[2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine
SMILESCN1CCN(c2cc(NN)nc(F)n2)CC1
InChIInChI=1S/C9H15FN6/c1-15-2-4-16(5-3-15)8-6-7(14-11)12-9(10)13-8/h6H,2-5,11H2,1H3,(H,12,13,14)
InChIKeyKQCHRZIPKZFTDM-UHFFFAOYSA-N
MW226.26 g/mol
LogP-0.35
Rot. Bonds2

About [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine

[2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine (PubChem CID 150851390) has the molecular formula C9H15FN6 and a molecular weight of 226.26 g/mol. Its IUPAC name is [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine
PubChem CID150851390
Molecular FormulaC9H15FN6
Molecular Weight226.26 g/mol
Exact Mass226.13
IUPAC Name[2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine
SMILESCN1CCN(c2cc(NN)nc(F)n2)CC1
InChIInChI=1S/C9H15FN6/c1-15-2-4-16(5-3-15)8-6-7(14-11)12-9(10)13-8/h6H,2-5,11H2,1H3,(H,12,13,14)
InChIKeyKQCHRZIPKZFTDM-UHFFFAOYSA-N
XLogP-0.35
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 5-0.35
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 [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-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 [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine (CID 150851390) is [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine is CN1CCN(c2cc(NN)nc(F)n2)CC1.
What is the InChIKey of [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is KQCHRZIPKZFTDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15FN6/c1-15-2-4-16(5-3-15)8-6-7(14-11)12-9(10)13-8/h6H,2-5,11H2,1H3,(H,12,13,14).
What are the key properties of [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine?
[2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 226.26 g/mol, XLogP of -0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 150851390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).