[2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol

C11H18N2O2S — CID 62753514

IUPAC[2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol
SMILESCCOC1CCN(c2ncc(CO)s2)CC1
InChIInChI=1S/C11H18N2O2S/c1-2-15-9-3-5-13(6-4-9)11-12-7-10(8-14)16-11/h7,9,14H,2-6,8H2,1H3
InChIKeyISTRMIUYIQZHTI-UHFFFAOYSA-N
MW242.34 g/mol
LogP1.64
Rot. Bonds4

About [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol

[2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol (PubChem CID 62753514) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol
PubChem CID62753514
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC Name[2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol
SMILESCCOC1CCN(c2ncc(CO)s2)CC1
InChIInChI=1S/C11H18N2O2S/c1-2-15-9-3-5-13(6-4-9)11-12-7-10(8-14)16-11/h7,9,14H,2-6,8H2,1H3
InChIKeyISTRMIUYIQZHTI-UHFFFAOYSA-N
XLogP1.64
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol (CID 62753514) is [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol is CCOC1CCN(c2ncc(CO)s2)CC1.
What is the InChIKey of [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol?
The InChIKey is ISTRMIUYIQZHTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-2-15-9-3-5-13(6-4-9)11-12-7-10(8-14)16-11/h7,9,14H,2-6,8H2,1H3.
What are the key properties of [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol?
[2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol has a molecular weight of 242.34 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethoxypiperidin-1-yl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 62753514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).