5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine

C8H8FN5S — CID 80921652

IUPAC5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine
SMILESNNc1ncc(F)c(Nc2ccsc2)n1
InChIInChI=1S/C8H8FN5S/c9-6-3-11-8(14-10)13-7(6)12-5-1-2-15-4-5/h1-4H,10H2,(H2,11,12,13,14)
InChIKeyWEELOIMNTZGRBS-UHFFFAOYSA-N
MW225.25 g/mol
LogP1.71
Rot. Bonds3

About 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine

5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine (PubChem CID 80921652) has the molecular formula C8H8FN5S and a molecular weight of 225.25 g/mol. Its IUPAC name is 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine
PubChem CID80921652
Molecular FormulaC8H8FN5S
Molecular Weight225.25 g/mol
Exact Mass225.05
IUPAC Name5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine
SMILESNNc1ncc(F)c(Nc2ccsc2)n1
InChIInChI=1S/C8H8FN5S/c9-6-3-11-8(14-10)13-7(6)12-5-1-2-15-4-5/h1-4H,10H2,(H2,11,12,13,14)
InChIKeyWEELOIMNTZGRBS-UHFFFAOYSA-N
XLogP1.71
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 51.71
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine?
The IUPAC name of 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine (CID 80921652) is 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine.
What is the SMILES notation for 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine?
The canonical SMILES for 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine is NNc1ncc(F)c(Nc2ccsc2)n1.
What is the InChIKey of 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine?
The InChIKey is WEELOIMNTZGRBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN5S/c9-6-3-11-8(14-10)13-7(6)12-5-1-2-15-4-5/h1-4H,10H2,(H2,11,12,13,14).
What are the key properties of 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine?
5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine has a molecular weight of 225.25 g/mol, XLogP of 1.71, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydrazinyl-N-thiophen-3-ylpyrimidin-4-amine is sourced from PubChem (CID 80921652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).