cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol

C10H12F3NOS — CID 106782097

IUPACcyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESOC(c1cnc(C(F)(F)F)s1)C1CCCC1
InChIInChI=1S/C10H12F3NOS/c11-10(12,13)9-14-5-7(16-9)8(15)6-3-1-2-4-6/h5-6,8,15H,1-4H2
InChIKeyMCGDKCVBKOSTKP-UHFFFAOYSA-N
MW251.27 g/mol
LogP3.39
Rot. Bonds2

About cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol

cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (PubChem CID 106782097) has the molecular formula C10H12F3NOS and a molecular weight of 251.27 g/mol. Its IUPAC name is cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Namecyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
PubChem CID106782097
Molecular FormulaC10H12F3NOS
Molecular Weight251.27 g/mol
Exact Mass251.06
IUPAC Namecyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESOC(c1cnc(C(F)(F)F)s1)C1CCCC1
InChIInChI=1S/C10H12F3NOS/c11-10(12,13)9-14-5-7(16-9)8(15)6-3-1-2-4-6/h5-6,8,15H,1-4H2
InChIKeyMCGDKCVBKOSTKP-UHFFFAOYSA-N
XLogP3.39
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.27
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (CID 106782097) is cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is OC(c1cnc(C(F)(F)F)s1)C1CCCC1.
What is the InChIKey of cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is MCGDKCVBKOSTKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NOS/c11-10(12,13)9-14-5-7(16-9)8(15)6-3-1-2-4-6/h5-6,8,15H,1-4H2.
What are the key properties of cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 251.27 g/mol, XLogP of 3.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 106782097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).