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

C8H13NO2S — CID 130906085

IUPAC2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol
SMILESCOC(C)C(O)c1cc(C)ns1
InChIInChI=1S/C8H13NO2S/c1-5-4-7(12-9-5)8(10)6(2)11-3/h4,6,8,10H,1-3H3
InChIKeyCXWITAOJJAJWTA-UHFFFAOYSA-N
MW187.26 g/mol
LogP1.52
Rot. Bonds3

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

2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol (PubChem CID 130906085) has the molecular formula C8H13NO2S and a molecular weight of 187.26 g/mol. Its IUPAC name is 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol.

Molecular Properties

Compound Name2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol
PubChem CID130906085
Molecular FormulaC8H13NO2S
Molecular Weight187.26 g/mol
Exact Mass187.07
IUPAC Name2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol
SMILESCOC(C)C(O)c1cc(C)ns1
InChIInChI=1S/C8H13NO2S/c1-5-4-7(12-9-5)8(10)6(2)11-3/h4,6,8,10H,1-3H3
InChIKeyCXWITAOJJAJWTA-UHFFFAOYSA-N
XLogP1.52
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-Methyl-1,2-thiazol-3-yl)ethanol
CID 45085688
(1R)-2,2,2-trifluoro-1-(3-methyl-1,2-thiazol-5-yl)ethanol
CID 130991631
(3-t-Butyl-isothiazol-5-yl)methanol
CID 57736297
3-Ethyl-5-isothiazolemethanol
CID 89816508
(5-Ethylisothiazol-3-yl)methanol
CID 164719542
3-(5-Ethyl-1,2-thiazol-3-yl)-3-hydroxy-2-iminopropanimidoyl iodide
CID 166833323
5-(1-Hydroxyethyl)-1,2-thiazole-3-carbonitrile
CID 82416630
2-(3-Methyl-1,2-thiazol-5-yl)ethan-1-ol
CID 83674199
I+/-,3-Dimethyl-5-isothiazoleethanol
CID 83675112
(3-Methyl-1,2-thiazol-5-yl)-(oxan-2-yl)methanol
CID 126985704
3-Amino-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol
CID 126985727
3-Methoxy-3-methyl-2-(3-methyl-1,2-thiazol-5-yl)butan-2-ol
CID 126985729

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol?
The IUPAC name of 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol (CID 130906085) is 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol.
What is the SMILES notation for 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol?
The canonical SMILES for 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol is COC(C)C(O)c1cc(C)ns1.
What is the InChIKey of 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol?
The InChIKey is CXWITAOJJAJWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2S/c1-5-4-7(12-9-5)8(10)6(2)11-3/h4,6,8,10H,1-3H3.
What are the key properties of 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol?
2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol has a molecular weight of 187.26 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(3-methyl-1,2-thiazol-5-yl)propan-1-ol is sourced from PubChem (CID 130906085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).