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

C9H14N2OS — CID 60964790

IUPAC[1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol
SMILESOCC1CCN(c2nccs2)CC1
InChIInChI=1S/C9H14N2OS/c12-7-8-1-4-11(5-2-8)9-10-3-6-13-9/h3,6,8,12H,1-2,4-5,7H2
InChIKeyNOYPUWLEWRYPEV-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.35
Rot. Bonds2

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

[1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol (PubChem CID 60964790) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol
PubChem CID60964790
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name[1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol
SMILESOCC1CCN(c2nccs2)CC1
InChIInChI=1S/C9H14N2OS/c12-7-8-1-4-11(5-2-8)9-10-3-6-13-9/h3,6,8,12H,1-2,4-5,7H2
InChIKeyNOYPUWLEWRYPEV-UHFFFAOYSA-N
XLogP1.35
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol?
The IUPAC name of [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol (CID 60964790) is [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol is OCC1CCN(c2nccs2)CC1.
What is the InChIKey of [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol?
The InChIKey is NOYPUWLEWRYPEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c12-7-8-1-4-11(5-2-8)9-10-3-6-13-9/h3,6,8,12H,1-2,4-5,7H2.
What are the key properties of [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol?
[1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol has a molecular weight of 198.29 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-thiazol-2-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 60964790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).