4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine

C5H7FN2S — CID 83854192

IUPAC4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine
SMILESCc1sc(N)nc1CF
InChIInChI=1S/C5H7FN2S/c1-3-4(2-6)8-5(7)9-3/h2H2,1H3,(H2,7,8)
InChIKeyDGBUGOAOKPRPDK-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.50
Rot. Bonds1

About 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine

4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine (PubChem CID 83854192) has the molecular formula C5H7FN2S and a molecular weight of 146.19 g/mol. Its IUPAC name is 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine
PubChem CID83854192
Molecular FormulaC5H7FN2S
Molecular Weight146.19 g/mol
Exact Mass146.03
IUPAC Name4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine
SMILESCc1sc(N)nc1CF
InChIInChI=1S/C5H7FN2S/c1-3-4(2-6)8-5(7)9-3/h2H2,1H3,(H2,7,8)
InChIKeyDGBUGOAOKPRPDK-UHFFFAOYSA-N
XLogP1.50
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine?
The IUPAC name of 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine (CID 83854192) is 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine is Cc1sc(N)nc1CF.
What is the InChIKey of 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine?
The InChIKey is DGBUGOAOKPRPDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FN2S/c1-3-4(2-6)8-5(7)9-3/h2H2,1H3,(H2,7,8).
What are the key properties of 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine?
4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine has a molecular weight of 146.19 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-5-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 83854192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).