4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol

C9H11F2NOS — CID 164659228

IUPAC4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
SMILESOC1(c2ccns2)CCC(F)(F)CC1
InChIInChI=1S/C9H11F2NOS/c10-9(11)4-2-8(13,3-5-9)7-1-6-12-14-7/h1,6,13H,2-5H2
InChIKeyGFUBHKYKIHHDNA-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.54
Rot. Bonds1

About 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol

4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol (PubChem CID 164659228) has the molecular formula C9H11F2NOS and a molecular weight of 219.26 g/mol. Its IUPAC name is 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
PubChem CID164659228
Molecular FormulaC9H11F2NOS
Molecular Weight219.26 g/mol
Exact Mass219.05
IUPAC Name4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
SMILESOC1(c2ccns2)CCC(F)(F)CC1
InChIInChI=1S/C9H11F2NOS/c10-9(11)4-2-8(13,3-5-9)7-1-6-12-14-7/h1,6,13H,2-5H2
InChIKeyGFUBHKYKIHHDNA-UHFFFAOYSA-N
XLogP2.54
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,3-Difluorocyclopentyl)-(1,2-thiazol-5-yl)methanol
CID 130826100
2-(2,2-Difluoro-1-methylcyclopropyl)-1-(1,2-thiazol-5-yl)ethan-1-ol
CID 164652164
4,4-Difluoro-1-(3-methyl-1,2-thiazol-5-yl)cyclohex-2-en-1-ol
CID 165492038
4,4-Difluoro-1-(1,2-thiazol-5-yl)cyclohex-2-en-1-ol
CID 165497804
4,4-Difluoro-1-[(1,2-thiazol-5-yl)methyl]cyclohex-2-en-1-ol
CID 165497805
1-(4-Bromo-1,2-thiazol-5-yl)-4,4-difluorocyclohex-2-en-1-ol
CID 165787684
2-(Isothiazol-5-YL)propan-2-OL
CID 45158877
4-Hydroxy-4-isothiazol-5-yl-cyclohexanone
CID 59361556
3-Cyclohexyl-1-(1,2-thiazol-5-yl)propan-1-ol
CID 59949219
4-Methyl-1-[2-(1,2-thiazol-5-yl)ethyl]cyclohex-2-en-1-ol
CID 155190878
2-Methyl-1-(1,2-thiazol-5-yl)cyclobutan-1-ol
CID 130826090
Cyclopentyl(1,2-thiazol-5-yl)methanol
CID 130826273

Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The IUPAC name of 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol (CID 164659228) is 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol.
What is the SMILES notation for 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The canonical SMILES for 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol is OC1(c2ccns2)CCC(F)(F)CC1.
What is the InChIKey of 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The InChIKey is GFUBHKYKIHHDNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2NOS/c10-9(11)4-2-8(13,3-5-9)7-1-6-12-14-7/h1,6,13H,2-5H2.
What are the key properties of 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol?
4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol has a molecular weight of 219.26 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol is sourced from PubChem (CID 164659228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).