2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol

C10H15NO2S — CID 130917848

IUPAC2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol
SMILESCCC1CC(O)(c2ccns2)CCO1
InChIInChI=1S/C10H15NO2S/c1-2-8-7-10(12,4-6-13-8)9-3-5-11-14-9/h3,5,8,12H,2,4,6-7H2,1H3
InChIKeyNSGPLSJCDRYPEG-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.92
Rot. Bonds2

About 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol

2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol (PubChem CID 130917848) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol.

Molecular Properties

Compound Name2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol
PubChem CID130917848
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol
SMILESCCC1CC(O)(c2ccns2)CCO1
InChIInChI=1S/C10H15NO2S/c1-2-8-7-10(12,4-6-13-8)9-3-5-11-14-9/h3,5,8,12H,2,4,6-7H2,1H3
InChIKeyNSGPLSJCDRYPEG-UHFFFAOYSA-N
XLogP1.92
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3,3-Difluorocyclopentyl)-(1,2-thiazol-5-yl)methanol
CID 130826100
4,4-Difluoro-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
CID 164659228
4,4-Difluoro-1-(1,2-thiazol-5-yl)cyclohex-2-en-1-ol
CID 165497804
2-(Isothiazol-5-YL)propan-2-OL
CID 45158877
8-Isothiazol-5-yl-1,4-dioxa-spiro[4.5]decan-8-ol
CID 59361591
3-Cyclohexyl-1-(1,2-thiazol-5-yl)propan-1-ol
CID 59949219
3-Ethoxy-1-(3-methyl-1,2-thiazol-5-yl)cyclobutan-1-ol
CID 127004477
(3-Methoxyoxolan-3-yl)-(1,2-thiazol-5-yl)methanol
CID 130802936
2-Methyl-1-(1,2-thiazol-5-yl)cyclobutan-1-ol
CID 130826090
Cyclopentyl(1,2-thiazol-5-yl)methanol
CID 130826273
3-Methoxy-1-(1,2-thiazol-5-yl)cyclohexan-1-ol
CID 130840880
6-(1,2-Thiazol-5-yl)-1,4-dioxepan-6-ol
CID 130840884

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol?
The IUPAC name of 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol (CID 130917848) is 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol.
What is the SMILES notation for 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol?
The canonical SMILES for 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol is CCC1CC(O)(c2ccns2)CCO1.
What is the InChIKey of 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol?
The InChIKey is NSGPLSJCDRYPEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-2-8-7-10(12,4-6-13-8)9-3-5-11-14-9/h3,5,8,12H,2,4,6-7H2,1H3.
What are the key properties of 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol?
2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol has a molecular weight of 213.30 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-(1,2-thiazol-5-yl)oxan-4-ol is sourced from PubChem (CID 130917848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).