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

C10H12F3NOS — CID 106781945

IUPAC1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
SMILESOC1(c2cnc(C(F)(F)F)s2)CCCCC1
InChIInChI=1S/C10H12F3NOS/c11-10(12,13)8-14-6-7(16-8)9(15)4-2-1-3-5-9/h6,15H,1-5H2
InChIKeyARRJNNUUGJFFSO-UHFFFAOYSA-N
MW251.27 g/mol
LogP3.31
Rot. Bonds1

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

1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol (PubChem CID 106781945) has the molecular formula C10H12F3NOS and a molecular weight of 251.27 g/mol. Its IUPAC name is 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
PubChem CID106781945
Molecular FormulaC10H12F3NOS
Molecular Weight251.27 g/mol
Exact Mass251.06
IUPAC Name1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
SMILESOC1(c2cnc(C(F)(F)F)s2)CCCCC1
InChIInChI=1S/C10H12F3NOS/c11-10(12,13)8-14-6-7(16-8)9(15)4-2-1-3-5-9/h6,15H,1-5H2
InChIKeyARRJNNUUGJFFSO-UHFFFAOYSA-N
XLogP3.31
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.27
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol?
The IUPAC name of 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol (CID 106781945) is 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol.
What is the SMILES notation for 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol?
The canonical SMILES for 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol is OC1(c2cnc(C(F)(F)F)s2)CCCCC1.
What is the InChIKey of 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol?
The InChIKey is ARRJNNUUGJFFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NOS/c11-10(12,13)8-14-6-7(16-8)9(15)4-2-1-3-5-9/h6,15H,1-5H2.
What are the key properties of 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol?
1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol has a molecular weight of 251.27 g/mol, XLogP of 3.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol is sourced from PubChem (CID 106781945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).