4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine

C8H5F3N2S2 — CID 125488890

IUPAC4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine
SMILESNc1nc(-c2cc(C(F)(F)F)cs2)cs1
InChIInChI=1S/C8H5F3N2S2/c9-8(10,11)4-1-6(14-2-4)5-3-15-7(12)13-5/h1-3H,(H2,12,13)
InChIKeyNVBNBULHDQSUQF-UHFFFAOYSA-N
MW250.27 g/mol
LogP3.47
Rot. Bonds1

About 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine

4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine (PubChem CID 125488890) has the molecular formula C8H5F3N2S2 and a molecular weight of 250.27 g/mol. Its IUPAC name is 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine
PubChem CID125488890
Molecular FormulaC8H5F3N2S2
Molecular Weight250.27 g/mol
Exact Mass249.98
IUPAC Name4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine
SMILESNc1nc(-c2cc(C(F)(F)F)cs2)cs1
InChIInChI=1S/C8H5F3N2S2/c9-8(10,11)4-1-6(14-2-4)5-3-15-7(12)13-5/h1-3H,(H2,12,13)
InChIKeyNVBNBULHDQSUQF-UHFFFAOYSA-N
XLogP3.47
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[4-(trifluoromethyl)thiophen-2-yl]-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

2-Amino-4-phenylthiazole
CID 40302
4-(2-Thienyl)-1,3-thiazol-2-amine
CID 243973
4-(4-Fluorophenyl)-1,3-thiazol-2-amine
CID 722371
4-(3,4-Difluorophenyl)-1,3-thiazol-2-amine
CID 706326
4-(3-(Trifluoromethyl)phenyl)-1,3-thiazol-2-amine
CID 706457
4-(4-(Trifluoromethyl)phenyl)-1,3-thiazol-2-amine
CID 2737741
4-(3-Fluorophenyl)-1,3-thiazol-2-amine
CID 777996
4-(2-Fluorophenyl)-1,3-thiazol-2-amine
CID 2737696
2-Amino-4-(2,4-difluorophenyl)thiazole
CID 611370
4-(5-Bromothiophen-2-yl)-1,3-thiazol-2-amine
CID 725239
(E)-4-phenyl-2-((E)-(thiophen-2-ylmethylene)hydrazono)-2,3-dihydrothiazole
CID 9556718
4-(5-Methylthiophen-2-yl)-1,3-thiazol-2-amine
CID 2063929

Frequently Asked Questions

What is the IUPAC name of 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine?
The IUPAC name of 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine (CID 125488890) is 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine is Nc1nc(-c2cc(C(F)(F)F)cs2)cs1.
What is the InChIKey of 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine?
The InChIKey is NVBNBULHDQSUQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F3N2S2/c9-8(10,11)4-1-6(14-2-4)5-3-15-7(12)13-5/h1-3H,(H2,12,13).
What are the key properties of 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine?
4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine has a molecular weight of 250.27 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(trifluoromethyl)thiophen-2-yl]-1,3-thiazol-2-amine is sourced from PubChem (CID 125488890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).