3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol

C10H10F3NOS — CID 106784213

IUPAC3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol
SMILESOC1C=C(c2cnc(C(F)(F)F)s2)CCC1
InChIInChI=1S/C10H10F3NOS/c11-10(12,13)9-14-5-8(16-9)6-2-1-3-7(15)4-6/h4-5,7,15H,1-3H2
InChIKeyJNBSTTGODMBBKN-UHFFFAOYSA-N
MW249.26 g/mol
LogP3.09
Rot. Bonds1

About 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol

3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol (PubChem CID 106784213) has the molecular formula C10H10F3NOS and a molecular weight of 249.26 g/mol. Its IUPAC name is 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol.

Molecular Properties

Compound Name3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol
PubChem CID106784213
Molecular FormulaC10H10F3NOS
Molecular Weight249.26 g/mol
Exact Mass249.04
IUPAC Name3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol
SMILESOC1C=C(c2cnc(C(F)(F)F)s2)CCC1
InChIInChI=1S/C10H10F3NOS/c11-10(12,13)9-14-5-8(16-9)6-2-1-3-7(15)4-6/h4-5,7,15H,1-3H2
InChIKeyJNBSTTGODMBBKN-UHFFFAOYSA-N
XLogP3.09
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.26
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-one
CID 106784131
3-(5-methylthiophen-2-yl)cyclohept-2-en-1-ol
CID 107383538
cyclopentyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
CID 106782444
2-methyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclopentan-1-ol
CID 106784212
1-cyclobutyl-3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pyrazol-5-amine
CID 176884304
3-(3,5-difluorophenyl)cyclohex-2-en-1-ol
CID 65177157
N-[[4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]phenyl]methyl]cyclopropanamine
CID 106783950
3-(6-methoxy-3-pyridinyl)cyclohex-2-en-1-ol
CID 10822113
[4-(trifluoromethyl)cyclohexyl]-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
CID 106786619
piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
CID 106782199
3-(5-fluoro-3-pyridinyl)cyclohept-2-en-1-ol
CID 107383485
5-[2-(trifluoromethyl)-1,3-thiazol-5-yl]-1H-pyrimidin-6-one
CID 106787601

Frequently Asked Questions

What is the IUPAC name of 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol?
The IUPAC name of 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol (CID 106784213) is 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol.
What is the SMILES notation for 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol?
The canonical SMILES for 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol is OC1C=C(c2cnc(C(F)(F)F)s2)CCC1.
What is the InChIKey of 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol?
The InChIKey is JNBSTTGODMBBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NOS/c11-10(12,13)9-14-5-8(16-9)6-2-1-3-7(15)4-6/h4-5,7,15H,1-3H2.
What are the key properties of 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol?
3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol has a molecular weight of 249.26 g/mol, XLogP of 3.09, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohex-2-en-1-ol is sourced from PubChem (CID 106784213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).