5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine

C8H11F3N2S — CID 88877673

IUPAC5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCC(C)(C)c1sc(N)nc1C(F)(F)F
InChIInChI=1S/C8H11F3N2S/c1-7(2,3)5-4(8(9,10)11)13-6(12)14-5/h1-3H3,(H2,12,13)
InChIKeyZNFKLRJPZDTZBG-UHFFFAOYSA-N
MW224.25 g/mol
LogP3.04
Rot. Bonds

About 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine

5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine (PubChem CID 88877673) has the molecular formula C8H11F3N2S and a molecular weight of 224.25 g/mol. Its IUPAC name is 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
PubChem CID88877673
Molecular FormulaC8H11F3N2S
Molecular Weight224.25 g/mol
Exact Mass224.06
IUPAC Name5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCC(C)(C)c1sc(N)nc1C(F)(F)F
InChIInChI=1S/C8H11F3N2S/c1-7(2,3)5-4(8(9,10)11)13-6(12)14-5/h1-3H3,(H2,12,13)
InChIKeyZNFKLRJPZDTZBG-UHFFFAOYSA-N
XLogP3.04
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.25
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Ethyl-5-methyl-1,3-thiazol-2-amine
CID 3164022
5-tert-butyl-N,4-dimethyl-1,3-thiazol-2-amine
CID 2304055
5-Methyl-4-(propan-2-yl)-1,3-thiazol-2-amine
CID 21138959
5-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-4-methyl-1,3-thiazol-2-amine
CID 130154004
5-tert-Butyl-4-methyl-thiazol-2-ylamine
CID 1081536
4-Ethyl-5-methyl-1,3-thiazol-2-amine hydrobromide
CID 42937515
5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-methyl-N-propan-2-yl-1,3-thiazol-2-amine
CID 135001092
4-Methyl-5-(propan-2-yl)-1,3-thiazol-2-amine
CID 10397060
5-Tert-butyl-4-ethyl-1,3-thiazol-2-amine
CID 85787683
5-Tert-butyl-2-pyrrolidin-1-yl-4-(trifluoromethyl)-1,3-thiazole
CID 58486393
5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 58486410
4-(Trifluoromethyl)-5-isopropylthiazol-2-amine
CID 85873307

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine (CID 88877673) is 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine is CC(C)(C)c1sc(N)nc1C(F)(F)F.
What is the InChIKey of 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The InChIKey is ZNFKLRJPZDTZBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N2S/c1-7(2,3)5-4(8(9,10)11)13-6(12)14-5/h1-3H3,(H2,12,13).
What are the key properties of 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine has a molecular weight of 224.25 g/mol, XLogP of 3.04, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-4-(trifluoromethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 88877673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).