4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine

C8H12FN3S — CID 59323572

IUPAC4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine
SMILESFc1csc(NC2CCNCC2)n1
InChIInChI=1S/C8H12FN3S/c9-7-5-13-8(12-7)11-6-1-3-10-4-2-6/h5-6,10H,1-4H2,(H,11,12)
InChIKeyZKNSBJILNWBGOR-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.45
Rot. Bonds2

About 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine

4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine (PubChem CID 59323572) has the molecular formula C8H12FN3S and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine
PubChem CID59323572
Molecular FormulaC8H12FN3S
Molecular Weight201.27 g/mol
Exact Mass201.07
IUPAC Name4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine
SMILESFc1csc(NC2CCNCC2)n1
InChIInChI=1S/C8H12FN3S/c9-7-5-13-8(12-7)11-6-1-3-10-4-2-6/h5-6,10H,1-4H2,(H,11,12)
InChIKeyZKNSBJILNWBGOR-UHFFFAOYSA-N
XLogP1.45
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine (CID 59323572) is 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine is Fc1csc(NC2CCNCC2)n1.
What is the InChIKey of 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine?
The InChIKey is ZKNSBJILNWBGOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12FN3S/c9-7-5-13-8(12-7)11-6-1-3-10-4-2-6/h5-6,10H,1-4H2,(H,11,12).
What are the key properties of 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine?
4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine has a molecular weight of 201.27 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-piperidin-4-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 59323572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).