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

C11H18N2OS — CID 63020655

IUPAC2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole
SMILESCc1ncc(COCC2CCNCC2)s1
InChIInChI=1S/C11H18N2OS/c1-9-13-6-11(15-9)8-14-7-10-2-4-12-5-3-10/h6,10,12H,2-5,7-8H2,1H3
InChIKeyHGHHGFOYKSLTJL-UHFFFAOYSA-N
MW226.34 g/mol
LogP1.97
Rot. Bonds4

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

2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole (PubChem CID 63020655) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is 2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole
PubChem CID63020655
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole
SMILESCc1ncc(COCC2CCNCC2)s1
InChIInChI=1S/C11H18N2OS/c1-9-13-6-11(15-9)8-14-7-10-2-4-12-5-3-10/h6,10,12H,2-5,7-8H2,1H3
InChIKeyHGHHGFOYKSLTJL-UHFFFAOYSA-N
XLogP1.97
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(4-Fluoropiperidin-4-yl)-1,3-thiazol-5-yl]methyl 2,2-dimethylpropanoate
CID 175265106
5-(Methoxymethyl)-2-piperidin-4-yl-1,3-thiazole
CID 58746977
1,3-thiazol-5-ylmethyl N-(2-piperidin-4-ylethyl)carbamate;hydrochloride
CID 67394505
1,3-thiazol-5-ylmethyl N-(2-piperidin-4-ylethyl)carbamate
CID 67394506
Ethyl 2-(piperidin-4-yl)-1,3-thiazole-5-carboxylate
CID 86701983
2-methyl-5-[[(3S)-piperidin-3-yl]methoxymethyl]-1,3-thiazole;hydrochloride
CID 140121435
(2-Piperidin-4-yl-1,3-thiazol-5-yl)methyl 2,2-dimethylpropanoate
CID 174960696
4-(2-Chloro-thiazol-5-ylmethoxy)-piperidine dihydrochloride
CID 45787161
4-[(2-Chloro-1,3-thiazol-5-yl)methoxy]piperidine
CID 45787162
(2-Chloro(1,3-thiazol-5-yl))(3-piperidylmethoxy)methane, chloride, chloride
CID 45787163
2-Chloro-5-(piperidin-3-ylmethoxymethyl)-1,3-thiazole
CID 45787164
3-((2-Chloro-1,3-thiazol-5-yl)methoxy)piperidine--hydrogen chloride (1/2)
CID 45787165

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole?
The IUPAC name of 2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole (CID 63020655) is 2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole.
What is the SMILES notation for 2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole?
The canonical SMILES for 2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole is Cc1ncc(COCC2CCNCC2)s1.
What is the InChIKey of 2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole?
The InChIKey is HGHHGFOYKSLTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-9-13-6-11(15-9)8-14-7-10-2-4-12-5-3-10/h6,10,12H,2-5,7-8H2,1H3.
What are the key properties of 2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole?
2-methyl-5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole has a molecular weight of 226.34 g/mol, XLogP of 1.97, 4 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-ylmethoxymethyl)-1,3-thiazole is sourced from PubChem (CID 63020655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).