3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol

C9H14N2OS — CID 164654965

IUPAC3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol
SMILESOC1CCNCC1Cc1ccns1
InChIInChI=1S/C9H14N2OS/c12-9-2-3-10-6-7(9)5-8-1-4-11-13-8/h1,4,7,9-10,12H,2-3,5-6H2
InChIKeyYDCDEIFDWMCFGN-UHFFFAOYSA-N
MW198.29 g/mol
LogP0.66
Rot. Bonds2

About 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol

3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol (PubChem CID 164654965) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol
PubChem CID164654965
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol
SMILESOC1CCNCC1Cc1ccns1
InChIInChI=1S/C9H14N2OS/c12-9-2-3-10-6-7(9)5-8-1-4-11-13-8/h1,4,7,9-10,12H,2-3,5-6H2
InChIKeyYDCDEIFDWMCFGN-UHFFFAOYSA-N
XLogP0.66
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[Fluoro(piperidin-3-yl)methyl]-1,2-thiazole
CID 130900890
5-Piperidin-4-yl-1,2-thiazole
CID 70115707
6-Methyl-3-[(1,2-thiazol-5-yl)methyl]piperidin-3-ol
CID 164652918
[(3s)-Pyrrolidin-3-yl](1,2-thiazol-5-yl)methanol
CID 164653630
1-[(3s)-Pyrrolidin-3-yl]-2-(1,2-thiazol-5-yl)ethan-1-ol
CID 164653636
2-(1,2-Thiazol-5-yl)-1-(thiomorpholin-2-yl)ethan-1-ol
CID 164653677
3-Methyl-4-(1,2-thiazol-5-yl)butan-2-ol
CID 164654962
2-[(1,2-Thiazol-5-yl)methyl]cyclohexan-1-ol
CID 164654964
3-[(1,2-Thiazol-5-yl)methyl]oxan-4-ol
CID 164654966
5-[2-(1,2-Thiazol-5-yl)ethyl]-1,2,3,6-tetrahydropyridin-3-ol
CID 165456178
4-[(1,2-Thiazol-5-yl)methyl]pyrrolidin-3-ol
CID 165524869
3-Methyl-5-(1,2-thiazol-5-yl)pentan-2-ol
CID 165589288

Frequently Asked Questions

What is the IUPAC name of 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol?
The IUPAC name of 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol (CID 164654965) is 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol?
The canonical SMILES for 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol is OC1CCNCC1Cc1ccns1.
What is the InChIKey of 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol?
The InChIKey is YDCDEIFDWMCFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c12-9-2-3-10-6-7(9)5-8-1-4-11-13-8/h1,4,7,9-10,12H,2-3,5-6H2.
What are the key properties of 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol?
3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol has a molecular weight of 198.29 g/mol, XLogP of 0.66, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2-thiazol-5-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 164654965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).