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

C10H16N2OS — CID 90419738

IUPAC4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol
SMILESCc1cc(CC2(O)CCNCC2)sn1
InChIInChI=1S/C10H16N2OS/c1-8-6-9(14-12-8)7-10(13)2-4-11-5-3-10/h6,11,13H,2-5,7H2,1H3
InChIKeyCUCHWUPZGSGYKM-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.11
Rot. Bonds2

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

4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol (PubChem CID 90419738) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol
PubChem CID90419738
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol
SMILESCc1cc(CC2(O)CCNCC2)sn1
InChIInChI=1S/C10H16N2OS/c1-8-6-9(14-12-8)7-10(13)2-4-11-5-3-10/h6,11,13H,2-5,7H2,1H3
InChIKeyCUCHWUPZGSGYKM-UHFFFAOYSA-N
XLogP1.11
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol?
The IUPAC name of 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol (CID 90419738) is 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol?
The canonical SMILES for 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol is Cc1cc(CC2(O)CCNCC2)sn1.
What is the InChIKey of 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol?
The InChIKey is CUCHWUPZGSGYKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8-6-9(14-12-8)7-10(13)2-4-11-5-3-10/h6,11,13H,2-5,7H2,1H3.
What are the key properties of 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol?
4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol has a molecular weight of 212.32 g/mol, XLogP of 1.11, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methyl-1,2-thiazol-5-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 90419738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).