2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole

C10H16N2OS — CID 82276880

IUPAC2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole
SMILESCOCc1nc(C2CCNCC2)cs1
InChIInChI=1S/C10H16N2OS/c1-13-6-10-12-9(7-14-10)8-2-4-11-5-3-8/h7-8,11H,2-6H2,1H3
InChIKeyKBJCONJQTLSMKO-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.76
Rot. Bonds3

About 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole

2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole (PubChem CID 82276880) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole.

Molecular Properties

Compound Name2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole
PubChem CID82276880
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole
SMILESCOCc1nc(C2CCNCC2)cs1
InChIInChI=1S/C10H16N2OS/c1-13-6-10-12-9(7-14-10)8-2-4-11-5-3-8/h7-8,11H,2-6H2,1H3
InChIKeyKBJCONJQTLSMKO-UHFFFAOYSA-N
XLogP1.76
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 ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole?
The IUPAC name of 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole (CID 82276880) is 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole.
What is the SMILES notation for 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole?
The canonical SMILES for 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole is COCc1nc(C2CCNCC2)cs1.
What is the InChIKey of 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole?
The InChIKey is KBJCONJQTLSMKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-13-6-10-12-9(7-14-10)8-2-4-11-5-3-8/h7-8,11H,2-6H2,1H3.
What are the key properties of 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole?
2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole has a molecular weight of 212.32 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-4-piperidin-4-yl-1,3-thiazole is sourced from PubChem (CID 82276880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).