3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol

C10H15NO2S — CID 130840880

IUPAC3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
SMILESCOC1CCCC(O)(c2ccns2)C1
InChIInChI=1S/C10H15NO2S/c1-13-8-3-2-5-10(12,7-8)9-4-6-11-14-9/h4,6,8,12H,2-3,5,7H2,1H3
InChIKeyAKMKXTTXABLFLO-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.92
Rot. Bonds2

About 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol

3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol (PubChem CID 130840880) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
PubChem CID130840880
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
SMILESCOC1CCCC(O)(c2ccns2)C1
InChIInChI=1S/C10H15NO2S/c1-13-8-3-2-5-10(12,7-8)9-4-6-11-14-9/h4,6,8,12H,2-3,5,7H2,1H3
InChIKeyAKMKXTTXABLFLO-UHFFFAOYSA-N
XLogP1.92
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,4-Difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
CID 164659228
3-Cyclohexyl-1-(1,2-thiazol-5-yl)propan-1-ol
CID 59949219
(3-Methoxyoxolan-3-yl)-(1,2-thiazol-5-yl)methanol
CID 130802936
7-Oxabicyclo[2.2.1]heptan-2-yl(1,2-thiazol-5-yl)methanol
CID 130856150
2,5-Dimethyl-3-(1,2-thiazol-5-yl)oxolan-3-ol
CID 130900900
(3-Methylcyclohexyl)-(1,2-thiazol-5-yl)methanol
CID 130914162
2-Ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol
CID 130917848
4-Ethyl-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
CID 130952206
3,3-Dimethyl-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
CID 130986279
3-Methyl-4-(1,2-thiazol-5-yl)oxan-4-ol
CID 131001013
2-Methyl-4-(1,2-thiazol-5-yl)oxan-4-ol
CID 131001014
(2-Methyloxolan-3-yl)-(1,2-thiazol-5-yl)methanol
CID 131001016

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The IUPAC name of 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol (CID 130840880) is 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol.
What is the SMILES notation for 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The canonical SMILES for 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol is COC1CCCC(O)(c2ccns2)C1.
What is the InChIKey of 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The InChIKey is AKMKXTTXABLFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-13-8-3-2-5-10(12,7-8)9-4-6-11-14-9/h4,6,8,12H,2-3,5,7H2,1H3.
What are the key properties of 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol?
3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol has a molecular weight of 213.30 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol is sourced from PubChem (CID 130840880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).