5-fluoro-4,5-dihydro-1,3-thiazol-2-amine

C3H5FN2S — CID 147210442

IUPAC5-fluoro-4,5-dihydro-1,3-thiazol-2-amine
SMILESNC1=NCC(F)S1
InChIInChI=1S/C3H5FN2S/c4-2-1-6-3(5)7-2/h2H,1H2,(H2,5,6)
InChIKeyCFBXRFWTRHZRPP-UHFFFAOYSA-N
MW120.15 g/mol
LogP0.34
Rot. Bonds

About 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine

5-fluoro-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 147210442) has the molecular formula C3H5FN2S and a molecular weight of 120.15 g/mol. Its IUPAC name is 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-fluoro-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID147210442
Molecular FormulaC3H5FN2S
Molecular Weight120.15 g/mol
Exact Mass120.02
IUPAC Name5-fluoro-4,5-dihydro-1,3-thiazol-2-amine
SMILESNC1=NCC(F)S1
InChIInChI=1S/C3H5FN2S/c4-2-1-6-3(5)7-2/h2H,1H2,(H2,5,6)
InChIKeyCFBXRFWTRHZRPP-UHFFFAOYSA-N
XLogP0.34
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine (CID 147210442) is 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine is NC1=NCC(F)S1.
What is the InChIKey of 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is CFBXRFWTRHZRPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5FN2S/c4-2-1-6-3(5)7-2/h2H,1H2,(H2,5,6).
What are the key properties of 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine?
5-fluoro-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 120.15 g/mol, XLogP of 0.34, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 147210442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).