1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol

C11H15F2NOS — CID 105123267

IUPAC1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol
SMILESOC(Cc1cncs1)C1CCC(F)(F)CC1
InChIInChI=1S/C11H15F2NOS/c12-11(13)3-1-8(2-4-11)10(15)5-9-6-14-7-16-9/h6-8,10,15H,1-5H2
InChIKeyFRPKXWWYJUYZST-UHFFFAOYSA-N
MW247.31 g/mol
LogP2.87
Rot. Bonds3

About 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol

1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol (PubChem CID 105123267) has the molecular formula C11H15F2NOS and a molecular weight of 247.31 g/mol. Its IUPAC name is 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol.

Molecular Properties

Compound Name1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol
PubChem CID105123267
Molecular FormulaC11H15F2NOS
Molecular Weight247.31 g/mol
Exact Mass247.08
IUPAC Name1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol
SMILESOC(Cc1cncs1)C1CCC(F)(F)CC1
InChIInChI=1S/C11H15F2NOS/c12-11(13)3-1-8(2-4-11)10(15)5-9-6-14-7-16-9/h6-8,10,15H,1-5H2
InChIKeyFRPKXWWYJUYZST-UHFFFAOYSA-N
XLogP2.87
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.31
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol with MolForge

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Related Compounds

3-(Difluoromethyl)-4-(1,3-thiazol-5-yl)cyclopentan-1-ol
CID 69550771
[(1R,2S,6R)-1,2-dimethyl-6-(1,3-thiazol-5-ylmethyl)cyclohexyl]methanol
CID 162402474
1-(1,3-Thiazol-5-yl)-4-(2,2,2-trifluoroethoxy)butan-2-ol
CID 103147379
4-(2,2-Difluoroethoxy)-1-(1,3-thiazol-5-yl)butan-2-ol
CID 103147645
4,4,4-Trifluoro-1-(1,3-thiazol-5-yl)-3-(trifluoromethyl)butan-2-ol
CID 103312621
(2S)-1,1,1-trifluoro-3-(1,3-thiazol-5-yl)propan-2-ol
CID 104373802
(2R)-1,1,1-trifluoro-3-(1,3-thiazol-5-yl)propan-2-ol
CID 104374030
2-(1,3-Thiazol-5-yl)-1-[3-(trifluoromethyl)cyclohexyl]ethanol
CID 105123269
1-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]cyclohexan-1-ol
CID 106781945
2-Ethyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butan-1-ol
CID 106782060
Cyclohexyl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
CID 106782063
2-Methyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butan-1-ol
CID 106782082

Frequently Asked Questions

What is the IUPAC name of 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol?
The IUPAC name of 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol (CID 105123267) is 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol.
What is the SMILES notation for 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol?
The canonical SMILES for 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol is OC(Cc1cncs1)C1CCC(F)(F)CC1.
What is the InChIKey of 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol?
The InChIKey is FRPKXWWYJUYZST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2NOS/c12-11(13)3-1-8(2-4-11)10(15)5-9-6-14-7-16-9/h6-8,10,15H,1-5H2.
What are the key properties of 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol?
1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol has a molecular weight of 247.31 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-difluorocyclohexyl)-2-(1,3-thiazol-5-yl)ethanol is sourced from PubChem (CID 105123267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).