N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine

C6H9FN2S — CID 130725337

IUPACN-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine
SMILESCc1cnc(NCCF)s1
InChIInChI=1S/C6H9FN2S/c1-5-4-9-6(10-5)8-3-2-7/h4H,2-3H2,1H3,(H,8,9)
InChIKeyJXTKJFWRYFFAMH-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.83
Rot. Bonds3

About N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine

N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine (PubChem CID 130725337) has the molecular formula C6H9FN2S and a molecular weight of 160.22 g/mol. Its IUPAC name is N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine
PubChem CID130725337
Molecular FormulaC6H9FN2S
Molecular Weight160.22 g/mol
Exact Mass160.05
IUPAC NameN-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine
SMILESCc1cnc(NCCF)s1
InChIInChI=1S/C6H9FN2S/c1-5-4-9-6(10-5)8-3-2-7/h4H,2-3H2,1H3,(H,8,9)
InChIKeyJXTKJFWRYFFAMH-UHFFFAOYSA-N
XLogP1.83
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine?
The IUPAC name of N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine (CID 130725337) is N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine is Cc1cnc(NCCF)s1.
What is the InChIKey of N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine?
The InChIKey is JXTKJFWRYFFAMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2S/c1-5-4-9-6(10-5)8-3-2-7/h4H,2-3H2,1H3,(H,8,9).
What are the key properties of N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine?
N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine has a molecular weight of 160.22 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-5-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 130725337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).