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

C10H15NO2S — CID 127004478

IUPAC2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
SMILESCOC1CCCCC1(O)c1ccsn1
InChIInChI=1S/C10H15NO2S/c1-13-9-4-2-3-6-10(9,12)8-5-7-14-11-8/h5,7,9,12H,2-4,6H2,1H3
InChIKeyKHWUDIDBYPYNKM-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.92
Rot. Bonds2

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

2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol (PubChem CID 127004478) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
PubChem CID127004478
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
SMILESCOC1CCCCC1(O)c1ccsn1
InChIInChI=1S/C10H15NO2S/c1-13-9-4-2-3-6-10(9,12)8-5-7-14-11-8/h5,7,9,12H,2-4,6H2,1H3
InChIKeyKHWUDIDBYPYNKM-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

1-[Hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol
CID 126985713
1-[Hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol
CID 126985714
3,3-Dimethyl-1-(1,2-thiazol-3-yl)butane-1,2-diol
CID 126985715
6-(1,2-Thiazol-3-yl)-1,4-dioxepan-6-ol
CID 126985767
2-Methoxy-2-methyl-1-(1,2-thiazol-3-yl)propan-1-ol
CID 127002572
4-Methyl-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127002594
2-Ethyl-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127002598
1-Methoxy-2-(1,2-thiazol-3-yl)propan-2-ol
CID 130604800
2,6-Dimethyl-4-(1,2-thiazol-3-yl)oxan-4-ol
CID 130620480
1-Cyclohexyl-1-(1,2-thiazol-3-yl)ethanol
CID 130627757
2-(1,2-Thiazol-3-yl)pentan-2-ol
CID 130634722
1-(1,2-Thiazol-3-yl)cyclohex-2-en-1-ol
CID 130649840

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol?
The IUPAC name of 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol (CID 127004478) is 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol.
What is the SMILES notation for 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol?
The canonical SMILES for 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol is COC1CCCCC1(O)c1ccsn1.
What is the InChIKey of 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol?
The InChIKey is KHWUDIDBYPYNKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-13-9-4-2-3-6-10(9,12)8-5-7-14-11-8/h5,7,9,12H,2-4,6H2,1H3.
What are the key properties of 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol?
2-methoxy-1-(1,2-thiazol-3-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 2-methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol is sourced from PubChem (CID 127004478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).