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

C9H14N2O2S — CID 130571237

IUPAC4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol
SMILESCOc1nc(C2(O)CCNCC2)cs1
InChIInChI=1S/C9H14N2O2S/c1-13-8-11-7(6-14-8)9(12)2-4-10-5-3-9/h6,10,12H,2-5H2,1H3
InChIKeyOVVPPUFJYXGJHK-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.72
Rot. Bonds2

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

4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol (PubChem CID 130571237) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol.

Molecular Properties

Compound Name4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol
PubChem CID130571237
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC Name4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol
SMILESCOc1nc(C2(O)CCNCC2)cs1
InChIInChI=1S/C9H14N2O2S/c1-13-8-11-7(6-14-8)9(12)2-4-10-5-3-9/h6,10,12H,2-5H2,1H3
InChIKeyOVVPPUFJYXGJHK-UHFFFAOYSA-N
XLogP0.72
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol?
The IUPAC name of 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol (CID 130571237) is 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol.
What is the SMILES notation for 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol?
The canonical SMILES for 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol is COc1nc(C2(O)CCNCC2)cs1.
What is the InChIKey of 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol?
The InChIKey is OVVPPUFJYXGJHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-13-8-11-7(6-14-8)9(12)2-4-10-5-3-9/h6,10,12H,2-5H2,1H3.
What are the key properties of 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol?
4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol has a molecular weight of 214.29 g/mol, XLogP of 0.72, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-1,3-thiazol-4-yl)piperidin-4-ol is sourced from PubChem (CID 130571237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).