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

C14H20F3NOS — CID 106781946

IUPAC5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
SMILESCC1CCC(C(C)C)C(O)(c2cnc(C(F)(F)F)s2)C1
InChIInChI=1S/C14H20F3NOS/c1-8(2)10-5-4-9(3)6-13(10,19)11-7-18-12(20-11)14(15,16)17/h7-10,19H,4-6H2,1-3H3
InChIKeyFKVZOXVKCADHII-UHFFFAOYSA-N
MW307.38 g/mol
LogP4.44
Rot. Bonds2

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

5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol (PubChem CID 106781946) has the molecular formula C14H20F3NOS and a molecular weight of 307.38 g/mol. Its IUPAC name is 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
PubChem CID106781946
Molecular FormulaC14H20F3NOS
Molecular Weight307.38 g/mol
Exact Mass307.12
IUPAC Name5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
SMILESCC1CCC(C(C)C)C(O)(c2cnc(C(F)(F)F)s2)C1
InChIInChI=1S/C14H20F3NOS/c1-8(2)10-5-4-9(3)6-13(10,19)11-7-18-12(20-11)14(15,16)17/h7-10,19H,4-6H2,1-3H3
InChIKeyFKVZOXVKCADHII-UHFFFAOYSA-N
XLogP4.44
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol with MolForge

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Related Compounds

2-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]adamantan-2-ol
CID 105551647
1-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781945
4-Propyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781947
4-Methyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781948
3,3,5-Trimethyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781949
4-(2-Methylbutan-2-yl)-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781950
4-Ethyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781951
4-Tert-butyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781952
2-Methyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781953
2-Tert-butyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781954
8-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]tricyclo[5.2.1.02,6]decan-8-ol
CID 106781955
1-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]cyclopentan-1-ol
CID 106781956

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol?
The IUPAC name of 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol (CID 106781946) is 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol.
What is the SMILES notation for 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol?
The canonical SMILES for 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol is CC1CCC(C(C)C)C(O)(c2cnc(C(F)(F)F)s2)C1.
What is the InChIKey of 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol?
The InChIKey is FKVZOXVKCADHII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F3NOS/c1-8(2)10-5-4-9(3)6-13(10,19)11-7-18-12(20-11)14(15,16)17/h7-10,19H,4-6H2,1-3H3.
What are the key properties of 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol?
5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol has a molecular weight of 307.38 g/mol, XLogP of 4.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-propan-2-yl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol is sourced from PubChem (CID 106781946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).