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

C9H15FN6 — CID 80927536

IUPAC[5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
SMILESCN1CCN(c2nc(NN)ncc2F)CC1
InChIInChI=1S/C9H15FN6/c1-15-2-4-16(5-3-15)8-7(10)6-12-9(13-8)14-11/h6H,2-5,11H2,1H3,(H,12,13,14)
InChIKeyGQMSFMPGODFWJY-UHFFFAOYSA-N
MW226.26 g/mol
LogP-0.35
Rot. Bonds2

About [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine

[5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine (PubChem CID 80927536) has the molecular formula C9H15FN6 and a molecular weight of 226.26 g/mol. Its IUPAC name is [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
PubChem CID80927536
Molecular FormulaC9H15FN6
Molecular Weight226.26 g/mol
Exact Mass226.13
IUPAC Name[5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
SMILESCN1CCN(c2nc(NN)ncc2F)CC1
InChIInChI=1S/C9H15FN6/c1-15-2-4-16(5-3-15)8-7(10)6-12-9(13-8)14-11/h6H,2-5,11H2,1H3,(H,12,13,14)
InChIKeyGQMSFMPGODFWJY-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 [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-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

Related Compounds

[5-fluoro-4-(4-methylazepan-1-yl)pyrimidin-2-yl]hydrazine
CID 80910776
2-[4-(5-fluoro-2-hydrazinylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanol
CID 107226856
[4-(3-azaspiro[5.5]undecan-3-yl)-5-fluoropyrimidin-2-yl]hydrazine
CID 80918943
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)pyrrolidine-3,4-diol
CID 106674672
[5-fluoro-4-(4-propylazepan-1-yl)pyrimidin-2-yl]hydrazine
CID 80917723
[4-(2,2-dimethylmorpholin-4-yl)-5-fluoropyrimidin-2-yl]hydrazine
CID 80906159
[4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-5-fluoropyrimidin-2-yl]hydrazine
CID 80930087
5-fluoro-N-methyl-4-pyrrolidin-1-ylpyrimidin-2-amine
CID 80766519
[5-fluoro-4-(3-methoxy-3-methylpiperidin-1-yl)pyrimidin-2-yl]hydrazine
CID 107396489
[4-(4-methyl-1,4-diazepan-1-yl)-5-nitropyrimidin-2-yl]hydrazine
CID 114045124
[4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103334986
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide
CID 80918438

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine?
The IUPAC name of [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine (CID 80927536) is [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine?
The canonical SMILES for [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine is CN1CCN(c2nc(NN)ncc2F)CC1.
What is the InChIKey of [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine?
The InChIKey is GQMSFMPGODFWJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15FN6/c1-15-2-4-16(5-3-15)8-7(10)6-12-9(13-8)14-11/h6H,2-5,11H2,1H3,(H,12,13,14).
What are the key properties of [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine?
[5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-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 [5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80927536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).