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

C7H11NO2S — CID 130604800

IUPAC1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol
SMILESCOCC(C)(O)c1ccsn1
InChIInChI=1S/C7H11NO2S/c1-7(9,5-10-2)6-3-4-11-8-6/h3-4,9H,5H2,1-2H3
InChIKeyXOMSVPMAOZHSII-UHFFFAOYSA-N
MW173.24 g/mol
LogP1.00
Rot. Bonds3

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

1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol (PubChem CID 130604800) has the molecular formula C7H11NO2S and a molecular weight of 173.24 g/mol. Its IUPAC name is 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol.

Molecular Properties

Compound Name1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol
PubChem CID130604800
Molecular FormulaC7H11NO2S
Molecular Weight173.24 g/mol
Exact Mass173.05
IUPAC Name1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol
SMILESCOCC(C)(O)c1ccsn1
InChIInChI=1S/C7H11NO2S/c1-7(9,5-10-2)6-3-4-11-8-6/h3-4,9H,5H2,1-2H3
InChIKeyXOMSVPMAOZHSII-UHFFFAOYSA-N
XLogP1.00
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 19017861
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CID 118480475
5-Methyl-2-(1,2-thiazol-3-yl)hex-3-yn-2-ol
CID 176629056
2-(1,2-Thiazol-3-yl)propan-2-ol
CID 119097575
3-Methyl-2-(1,2-thiazol-3-yl)butan-2-ol
CID 126985702
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
2-Methoxy-1-(1,2-thiazol-3-yl)cyclohexan-1-ol
CID 127004478
1-(1,2-Thiazol-3-yl)propane-1,2-diol
CID 130604797

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol?
The IUPAC name of 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol (CID 130604800) is 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol.
What is the SMILES notation for 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol?
The canonical SMILES for 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol is COCC(C)(O)c1ccsn1.
What is the InChIKey of 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol?
The InChIKey is XOMSVPMAOZHSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2S/c1-7(9,5-10-2)6-3-4-11-8-6/h3-4,9H,5H2,1-2H3.
What are the key properties of 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol?
1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol has a molecular weight of 173.24 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-(1,2-thiazol-3-yl)propan-2-ol is sourced from PubChem (CID 130604800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).