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

C11H17NO2S — CID 106873763

IUPAC2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol
SMILESCOC1CCCCC1(O)Cc1cncs1
InChIInChI=1S/C11H17NO2S/c1-14-10-4-2-3-5-11(10,13)6-9-7-12-8-15-9/h7-8,10,13H,2-6H2,1H3
InChIKeyOSCUJGYWAAMYME-UHFFFAOYSA-N
MW227.33 g/mol
LogP2.01
Rot. Bonds3

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

2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol (PubChem CID 106873763) has the molecular formula C11H17NO2S and a molecular weight of 227.33 g/mol. Its IUPAC name is 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol
PubChem CID106873763
Molecular FormulaC11H17NO2S
Molecular Weight227.33 g/mol
Exact Mass227.10
IUPAC Name2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol
SMILESCOC1CCCCC1(O)Cc1cncs1
InChIInChI=1S/C11H17NO2S/c1-14-10-4-2-3-5-11(10,13)6-9-7-12-8-15-9/h7-8,10,13H,2-6H2,1H3
InChIKeyOSCUJGYWAAMYME-UHFFFAOYSA-N
XLogP2.01
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol?
The IUPAC name of 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol (CID 106873763) is 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol.
What is the SMILES notation for 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol?
The canonical SMILES for 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol is COC1CCCCC1(O)Cc1cncs1.
What is the InChIKey of 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol?
The InChIKey is OSCUJGYWAAMYME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2S/c1-14-10-4-2-3-5-11(10,13)6-9-7-12-8-15-9/h7-8,10,13H,2-6H2,1H3.
What are the key properties of 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol?
2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol has a molecular weight of 227.33 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol is sourced from PubChem (CID 106873763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).