2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole

C10H16N2OS — CID 63020482

IUPAC2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole
SMILESCc1ncc(COC2CCNCC2)s1
InChIInChI=1S/C10H16N2OS/c1-8-12-6-10(14-8)7-13-9-2-4-11-5-3-9/h6,9,11H,2-5,7H2,1H3
InChIKeyZNCNXNBIMHAILQ-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.72
Rot. Bonds3

About 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole

2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole (PubChem CID 63020482) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole
PubChem CID63020482
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole
SMILESCc1ncc(COC2CCNCC2)s1
InChIInChI=1S/C10H16N2OS/c1-8-12-6-10(14-8)7-13-9-2-4-11-5-3-9/h6,9,11H,2-5,7H2,1H3
InChIKeyZNCNXNBIMHAILQ-UHFFFAOYSA-N
XLogP1.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole?
The IUPAC name of 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole (CID 63020482) is 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole.
What is the SMILES notation for 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole?
The canonical SMILES for 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole is Cc1ncc(COC2CCNCC2)s1.
What is the InChIKey of 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole?
The InChIKey is ZNCNXNBIMHAILQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8-12-6-10(14-8)7-13-9-2-4-11-5-3-9/h6,9,11H,2-5,7H2,1H3.
What are the key properties of 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole?
2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole has a molecular weight of 212.32 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(piperidin-4-yloxymethyl)-1,3-thiazole is sourced from PubChem (CID 63020482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).