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

C9H14N2OS — CID 69450404

IUPAC4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol
SMILESCc1cnc(C2(O)CCNCC2)s1
InChIInChI=1S/C9H14N2OS/c1-7-6-11-8(13-7)9(12)2-4-10-5-3-9/h6,10,12H,2-5H2,1H3
InChIKeyJURMWCISBDTSLW-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.02
Rot. Bonds1

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

4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol (PubChem CID 69450404) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol.

Molecular Properties

Compound Name4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol
PubChem CID69450404
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol
SMILESCc1cnc(C2(O)CCNCC2)s1
InChIInChI=1S/C9H14N2OS/c1-7-6-11-8(13-7)9(12)2-4-10-5-3-9/h6,10,12H,2-5H2,1H3
InChIKeyJURMWCISBDTSLW-UHFFFAOYSA-N
XLogP1.02
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol?
The IUPAC name of 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol (CID 69450404) is 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol.
What is the SMILES notation for 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol?
The canonical SMILES for 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol is Cc1cnc(C2(O)CCNCC2)s1.
What is the InChIKey of 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol?
The InChIKey is JURMWCISBDTSLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-7-6-11-8(13-7)9(12)2-4-10-5-3-9/h6,10,12H,2-5H2,1H3.
What are the key properties of 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol?
4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol has a molecular weight of 198.29 g/mol, XLogP of 1.02, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-1,3-thiazol-2-yl)piperidin-4-ol is sourced from PubChem (CID 69450404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).