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

C11H17NOS — CID 164648580

IUPAC2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol
SMILESCC1CCC(C)C(O)(c2cnsc2)C1
InChIInChI=1S/C11H17NOS/c1-8-3-4-9(2)11(13,5-8)10-6-12-14-7-10/h6-9,13H,3-5H2,1-2H3
InChIKeyLDZLZMFYWRWIFL-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.79
Rot. Bonds1

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

2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol (PubChem CID 164648580) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol
PubChem CID164648580
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol
SMILESCC1CCC(C)C(O)(c2cnsc2)C1
InChIInChI=1S/C11H17NOS/c1-8-3-4-9(2)11(13,5-8)10-6-12-14-7-10/h6-9,13H,3-5H2,1-2H3
InChIKeyLDZLZMFYWRWIFL-UHFFFAOYSA-N
XLogP2.79
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R,2S,5R)-2,5-dimethyl-1-phenylcyclohexan-1-ol
CID 124672757
1-(3,5-difluorophenyl)-2,5-dimethylcyclohexan-1-ol
CID 64753777
1-(4-chlorophenyl)-2,5-dimethylcyclohexan-1-ol
CID 64755424
1-(3,4-dichlorophenyl)-2,5-dimethylcyclohexan-1-ol
CID 64755423
2-ethyl-1-(1,2-thiazol-4-yl)cyclopentan-1-ol
CID 164648660
2,5-dimethyl-1-quinolin-3-ylcyclohexan-1-ol
CID 64755422
2-methyl-4-(1,2-thiazol-4-yl)oxan-4-ol
CID 164648675
1-(3-methoxyphenyl)-2,5-dimethylcyclohexan-1-ol
CID 64756237
2,5-dimethylcyclohexane-1,1-diol
CID 147718738
1-(4-bromo-1-propan-2-ylpyrazol-5-yl)-2,5-dimethylcyclohexan-1-ol
CID 114636081
1-[4-fluoro-3-(trifluoromethyl)phenyl]-2,5-dimethylcyclohexan-1-ol
CID 107287447
2,5-dimethyl-1-[4-(trifluoromethyl)-3-pyridinyl]cyclohexan-1-ol
CID 102707348

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol?
The IUPAC name of 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol (CID 164648580) is 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol.
What is the SMILES notation for 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol?
The canonical SMILES for 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol is CC1CCC(C)C(O)(c2cnsc2)C1.
What is the InChIKey of 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol?
The InChIKey is LDZLZMFYWRWIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-8-3-4-9(2)11(13,5-8)10-6-12-14-7-10/h6-9,13H,3-5H2,1-2H3.
What are the key properties of 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol?
2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol has a molecular weight of 211.33 g/mol, XLogP of 2.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1-(1,2-thiazol-4-yl)cyclohexan-1-ol is sourced from PubChem (CID 164648580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).