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

C12H16F3NO2S — CID 106782895

IUPAC(1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESCCOC1(C(O)c2cnc(C(F)(F)F)s2)CCCC1
InChIInChI=1S/C12H16F3NO2S/c1-2-18-11(5-3-4-6-11)9(17)8-7-16-10(19-8)12(13,14)15/h7,9,17H,2-6H2,1H3
InChIKeyGOESMTHCSVFIJH-UHFFFAOYSA-N
MW295.33 g/mol
LogP3.54
Rot. Bonds4

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

(1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (PubChem CID 106782895) has the molecular formula C12H16F3NO2S and a molecular weight of 295.33 g/mol. Its IUPAC name is (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name(1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
PubChem CID106782895
Molecular FormulaC12H16F3NO2S
Molecular Weight295.33 g/mol
Exact Mass295.09
IUPAC Name(1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESCCOC1(C(O)c2cnc(C(F)(F)F)s2)CCCC1
InChIInChI=1S/C12H16F3NO2S/c1-2-18-11(5-3-4-6-11)9(17)8-7-16-10(19-8)12(13,14)15/h7,9,17H,2-6H2,1H3
InChIKeyGOESMTHCSVFIJH-UHFFFAOYSA-N
XLogP3.54
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.33
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(2-methylpropyl)cyclopentyl]-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
CID 106786567
(1-methoxycyclohexyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
CID 106783739
N-[(1-methoxycyclobutyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]propan-1-amine
CID 106783684
(5-chlorothiophen-2-yl)-(1-ethoxycyclohexyl)methanol
CID 116753583
1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butane-1,2-diol
CID 106782928
N-[(1-methylcyclohexyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 106830795
(1-ethoxycycloheptyl)-(1-ethylimidazol-2-yl)methanol
CID 116756208
4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pentan-2-one
CID 106784127
(3,5-difluorophenyl)-(1-ethoxycycloheptyl)methanol
CID 116756092
(4-amino-3-pyridinyl)-(1-ethoxycycloheptyl)methanol
CID 116756255
(1-ethoxycyclopentyl)-(4-methyl-3-pyridinyl)methanol
CID 116753217
2-methyl-2-pyrrolidin-1-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butan-1-amine
CID 106783424

Frequently Asked Questions

What is the IUPAC name of (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (CID 106782895) is (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is CCOC1(C(O)c2cnc(C(F)(F)F)s2)CCCC1.
What is the InChIKey of (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is GOESMTHCSVFIJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F3NO2S/c1-2-18-11(5-3-4-6-11)9(17)8-7-16-10(19-8)12(13,14)15/h7,9,17H,2-6H2,1H3.
What are the key properties of (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
(1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 295.33 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxycyclopentyl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 106782895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).