5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole

C10H11ClF3NS — CID 106784219

IUPAC5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole
SMILESFC(F)(F)c1ncc(C2CCCC(Cl)C2)s1
InChIInChI=1S/C10H11ClF3NS/c11-7-3-1-2-6(4-7)8-5-15-9(16-8)10(12,13)14/h5-7H,1-4H2
InChIKeyTXSNSOIZCHGWDA-UHFFFAOYSA-N
MW269.72 g/mol
LogP4.43
Rot. Bonds1

About 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole

5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole (PubChem CID 106784219) has the molecular formula C10H11ClF3NS and a molecular weight of 269.72 g/mol. Its IUPAC name is 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole.

Molecular Properties

Compound Name5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole
PubChem CID106784219
Molecular FormulaC10H11ClF3NS
Molecular Weight269.72 g/mol
Exact Mass269.03
IUPAC Name5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole
SMILESFC(F)(F)c1ncc(C2CCCC(Cl)C2)s1
InChIInChI=1S/C10H11ClF3NS/c11-7-3-1-2-6(4-7)8-5-15-9(16-8)10(12,13)14/h5-7H,1-4H2
InChIKeyTXSNSOIZCHGWDA-UHFFFAOYSA-N
XLogP4.43
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.72
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole 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-methyl-2-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexane-1-carboxylic acid
CID 106784494
N-[[2-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclopentyl]methyl]propan-2-amine
CID 106784544
2-methyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclopentan-1-ol
CID 106784212
3-(3-chlorocyclohexyl)-5-fluoropyridine
CID 64514703
cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
CID 106782444
1-chloro-3-[2-(trifluoromethyl)phenyl]cycloheptane
CID 64507732
4,4-dimethyl-2-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-amine
CID 106784508
N-[[2-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexyl]methyl]propan-1-amine
CID 106784550
2-tert-butyl-5-(4-tert-butylcyclohexyl)-1,3-thiazole
CID 70849917
1-chloro-3-[3-(trifluoromethyl)phenyl]cycloheptane
CID 64506404
5-cyclobutyl-2-(trifluoromethyl)-1H-imidazole
CID 116883636
1-chloro-3-(2,6-difluorophenyl)cycloheptane
CID 64508867

Frequently Asked Questions

What is the IUPAC name of 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole?
The IUPAC name of 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole (CID 106784219) is 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole.
What is the SMILES notation for 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole?
The canonical SMILES for 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole is FC(F)(F)c1ncc(C2CCCC(Cl)C2)s1.
What is the InChIKey of 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole?
The InChIKey is TXSNSOIZCHGWDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClF3NS/c11-7-3-1-2-6(4-7)8-5-15-9(16-8)10(12,13)14/h5-7H,1-4H2.
What are the key properties of 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole?
5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole has a molecular weight of 269.72 g/mol, XLogP of 4.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chlorocyclohexyl)-2-(trifluoromethyl)-1,3-thiazole is sourced from PubChem (CID 106784219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).