(2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol

C10H15NO2S — CID 131140404

IUPAC(2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol
SMILESCCC1OCCC1C(O)c1ccsn1
InChIInChI=1S/C10H15NO2S/c1-2-9-7(3-5-13-9)10(12)8-4-6-14-11-8/h4,6-7,9-10,12H,2-3,5H2,1H3
InChIKeyPFXVUFKWKVHHLC-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.99
Rot. Bonds3

About (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol

(2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol (PubChem CID 131140404) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol.

Molecular Properties

Compound Name(2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol
PubChem CID131140404
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name(2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol
SMILESCCC1OCCC1C(O)c1ccsn1
InChIInChI=1S/C10H15NO2S/c1-2-9-7(3-5-13-9)10(12)8-4-6-14-11-8/h4,6-7,9-10,12H,2-3,5H2,1H3
InChIKeyPFXVUFKWKVHHLC-UHFFFAOYSA-N
XLogP1.99
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.99
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
1-(Oxolan-3-yl)-1-(1,2-thiazol-3-yl)propan-1-ol
CID 126985740
3-(3-Methyl-1,2-thiazol-5-yl)oxolan-3-ol
CID 126985746
2,6-Dimethyl-4-(1,2-thiazol-3-yl)oxan-4-ol
CID 130620480
3-Methyl-1-(1,2-thiazol-3-yl)butane-1,2-diol
CID 130659054
1,2-Thiazol-3-yl(thiolan-3-yl)methanol
CID 130694348
2,2-Dimethyl-4-(1,2-thiazol-3-yl)oxan-4-ol
CID 130702883
(1-Methylcyclopentyl)-(1,2-thiazol-3-yl)methanol
CID 130706869
(2-Methyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol
CID 130715054
2-Cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol
CID 130718298
(4-Methylcyclohexyl)-(1,2-thiazol-3-yl)methanol
CID 130725484

Frequently Asked Questions

What is the IUPAC name of (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol?
The IUPAC name of (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol (CID 131140404) is (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol.
What is the SMILES notation for (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol?
The canonical SMILES for (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol is CCC1OCCC1C(O)c1ccsn1.
What is the InChIKey of (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol?
The InChIKey is PFXVUFKWKVHHLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-2-9-7(3-5-13-9)10(12)8-4-6-14-11-8/h4,6-7,9-10,12H,2-3,5H2,1H3.
What are the key properties of (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol?
(2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol has a molecular weight of 213.30 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyloxolan-3-yl)-(1,2-thiazol-3-yl)methanol is sourced from PubChem (CID 131140404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).