5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole

C10H16N2OS — CID 130943391

IUPAC5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole
SMILESCC1CCC(OCc2cncs2)CN1
InChIInChI=1S/C10H16N2OS/c1-8-2-3-9(4-12-8)13-6-10-5-11-7-14-10/h5,7-9,12H,2-4,6H2,1H3
InChIKeyFSOFZKURCTWOFP-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.80
Rot. Bonds3

About 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole

5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole (PubChem CID 130943391) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole.

Molecular Properties

Compound Name5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole
PubChem CID130943391
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole
SMILESCC1CCC(OCc2cncs2)CN1
InChIInChI=1S/C10H16N2OS/c1-8-2-3-9(4-12-8)13-6-10-5-11-7-14-10/h5,7-9,12H,2-4,6H2,1H3
InChIKeyFSOFZKURCTWOFP-UHFFFAOYSA-N
XLogP1.80
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 ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole?
The IUPAC name of 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole (CID 130943391) is 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole.
What is the SMILES notation for 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole?
The canonical SMILES for 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole is CC1CCC(OCc2cncs2)CN1.
What is the InChIKey of 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole?
The InChIKey is FSOFZKURCTWOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8-2-3-9(4-12-8)13-6-10-5-11-7-14-10/h5,7-9,12H,2-4,6H2,1H3.
What are the key properties of 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole?
5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole has a molecular weight of 212.32 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-methylpiperidin-3-yl)oxymethyl]-1,3-thiazole is sourced from PubChem (CID 130943391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).