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

C7H11NO2S — CID 130593238

IUPAC3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol
SMILESCOc1ncc(CCCO)s1
InChIInChI=1S/C7H11NO2S/c1-10-7-8-5-6(11-7)3-2-4-9/h5,9H,2-4H2,1H3
InChIKeyZAGMOGFZIHTXRS-UHFFFAOYSA-N
MW173.24 g/mol
LogP1.08
Rot. Bonds4

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

3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol (PubChem CID 130593238) has the molecular formula C7H11NO2S and a molecular weight of 173.24 g/mol. Its IUPAC name is 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol.

Molecular Properties

Compound Name3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol
PubChem CID130593238
Molecular FormulaC7H11NO2S
Molecular Weight173.24 g/mol
Exact Mass173.05
IUPAC Name3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol
SMILESCOc1ncc(CCCO)s1
InChIInChI=1S/C7H11NO2S/c1-10-7-8-5-6(11-7)3-2-4-9/h5,9H,2-4H2,1H3
InChIKeyZAGMOGFZIHTXRS-UHFFFAOYSA-N
XLogP1.08
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1,3-Thiazol-5-yl)propan-1-ol
CID 17957431
3-(2-Methyl-1,3-thiazol-5-yl)propanoic acid
CID 20388953
3-(1,3-Thiazol-5-yl)propanoic acid hydrochloride
CID 119032094
2-Amino-3-(1,3-thiazol-5-yl)propan-1-ol dihydrochloride
CID 126796872
2-Amino-3-(1,3-thiazol-5-yl)propan-1-ol
CID 17957449
3-Amino-3-(1,3-thiazol-5-yl)propan-1-ol
CID 55255831
1-(1,3-Thiazol-5-yl)-3-(2,2,2-trifluoroethoxy)propan-2-ol
CID 103217063
3-Methoxy-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]propan-1-ol
CID 106782724
3-Methoxy-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butan-1-ol
CID 106782877
3-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]propan-1-ol
CID 106784198
4-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]butan-2-ol
CID 106784199
1-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]hexan-3-ol
CID 106784202

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol?
The IUPAC name of 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol (CID 130593238) is 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol.
What is the SMILES notation for 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol?
The canonical SMILES for 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol is COc1ncc(CCCO)s1.
What is the InChIKey of 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol?
The InChIKey is ZAGMOGFZIHTXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2S/c1-10-7-8-5-6(11-7)3-2-4-9/h5,9H,2-4H2,1H3.
What are the key properties of 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol?
3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol has a molecular weight of 173.24 g/mol, XLogP of 1.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-1,3-thiazol-5-yl)propan-1-ol is sourced from PubChem (CID 130593238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).