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

C10H6F3NS — CID 138984066

IUPAC5-phenyl-2-(trifluoromethyl)-1,3-thiazole
SMILESFC(F)(F)c1ncc(-c2ccccc2)s1
InChIInChI=1S/C10H6F3NS/c11-10(12,13)9-14-6-8(15-9)7-4-2-1-3-5-7/h1-6H
InChIKeyNHPOFJXVCRHPJN-UHFFFAOYSA-N
MW229.23 g/mol
LogP3.83
Rot. Bonds1

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

5-phenyl-2-(trifluoromethyl)-1,3-thiazole (PubChem CID 138984066) has the molecular formula C10H6F3NS and a molecular weight of 229.23 g/mol. Its IUPAC name is 5-phenyl-2-(trifluoromethyl)-1,3-thiazole.

Molecular Properties

Compound Name5-phenyl-2-(trifluoromethyl)-1,3-thiazole
PubChem CID138984066
Molecular FormulaC10H6F3NS
Molecular Weight229.23 g/mol
Exact Mass229.02
IUPAC Name5-phenyl-2-(trifluoromethyl)-1,3-thiazole
SMILESFC(F)(F)c1ncc(-c2ccccc2)s1
InChIInChI=1S/C10H6F3NS/c11-10(12,13)9-14-6-8(15-9)7-4-2-1-3-5-7/h1-6H
InChIKeyNHPOFJXVCRHPJN-UHFFFAOYSA-N
XLogP3.83
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-{[4-(Trifluoromethyl)phenyl]methyl}-1,3-thiazol-2-amine
CID 16228111
(2-Phenyl-1,3-thiazol-5-yl)methanamine
CID 595758
5-Phenyl-thiazol-2-ylamine
CID 873119
5-Phenylthiazole
CID 595209
(5-Phenylthiazol-2-yl)methanol
CID 273543
5-Methyl-2-phenyl-1,3-thiazole
CID 551875
2-Bromo-5-phenyl-1,3-thiazole
CID 10728723
2-Benzyl-1,3-thiazole
CID 21183829
5-(1H-inden-1-ylmethyl)-1,3-thiazole
CID 42628292
5-(4-Fluoro-benzyl)-thiazol-2-ylamine
CID 703479
2,5-Diphenylthiazole
CID 3014233
2-Chloro-5-phenyl-1,3-thiazole
CID 21788840

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-2-(trifluoromethyl)-1,3-thiazole?
The IUPAC name of 5-phenyl-2-(trifluoromethyl)-1,3-thiazole (CID 138984066) is 5-phenyl-2-(trifluoromethyl)-1,3-thiazole.
What is the SMILES notation for 5-phenyl-2-(trifluoromethyl)-1,3-thiazole?
The canonical SMILES for 5-phenyl-2-(trifluoromethyl)-1,3-thiazole is FC(F)(F)c1ncc(-c2ccccc2)s1.
What is the InChIKey of 5-phenyl-2-(trifluoromethyl)-1,3-thiazole?
The InChIKey is NHPOFJXVCRHPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F3NS/c11-10(12,13)9-14-6-8(15-9)7-4-2-1-3-5-7/h1-6H.
What are the key properties of 5-phenyl-2-(trifluoromethyl)-1,3-thiazole?
5-phenyl-2-(trifluoromethyl)-1,3-thiazole has a molecular weight of 229.23 g/mol, XLogP of 3.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-2-(trifluoromethyl)-1,3-thiazole is sourced from PubChem (CID 138984066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).