2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine

C8H10FN3S — CID 112562782

IUPAC2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine
SMILESNCC(F)Cc1cn2ccsc2n1
InChIInChI=1S/C8H10FN3S/c9-6(4-10)3-7-5-12-1-2-13-8(12)11-7/h1-2,5-6H,3-4,10H2
InChIKeyHJMWFJVTNDJIML-UHFFFAOYSA-N
MW199.25 g/mol
LogP1.24
Rot. Bonds3

About 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine

2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine (PubChem CID 112562782) has the molecular formula C8H10FN3S and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine.

Molecular Properties

Compound Name2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine
PubChem CID112562782
Molecular FormulaC8H10FN3S
Molecular Weight199.25 g/mol
Exact Mass199.06
IUPAC Name2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine
SMILESNCC(F)Cc1cn2ccsc2n1
InChIInChI=1S/C8H10FN3S/c9-6(4-10)3-7-5-12-1-2-13-8(12)11-7/h1-2,5-6H,3-4,10H2
InChIKeyHJMWFJVTNDJIML-UHFFFAOYSA-N
XLogP1.24
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine?
The IUPAC name of 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine (CID 112562782) is 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine.
What is the SMILES notation for 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine?
The canonical SMILES for 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine is NCC(F)Cc1cn2ccsc2n1.
What is the InChIKey of 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine?
The InChIKey is HJMWFJVTNDJIML-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3S/c9-6(4-10)3-7-5-12-1-2-13-8(12)11-7/h1-2,5-6H,3-4,10H2.
What are the key properties of 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine?
2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine has a molecular weight of 199.25 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine is sourced from PubChem (CID 112562782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).