5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride

C10H17ClN2OS — CID 71637010

IUPAC5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride
SMILESCl.c1ncc(COCC2CCNCC2)s1
InChIInChI=1S/C10H16N2OS.ClH/c1-3-11-4-2-9(1)6-13-7-10-5-12-8-14-10;/h5,8-9,11H,1-4,6-7H2;1H
InChIKeyQLWUEPRWAICYEM-UHFFFAOYSA-N
MW248.78 g/mol
LogP2.08
Rot. Bonds4

About 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride

5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride (PubChem CID 71637010) has the molecular formula C10H17ClN2OS and a molecular weight of 248.78 g/mol. Its IUPAC name is 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride.

Molecular Properties

Compound Name5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride
PubChem CID71637010
Molecular FormulaC10H17ClN2OS
Molecular Weight248.78 g/mol
Exact Mass248.08
IUPAC Name5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride
SMILESCl.c1ncc(COCC2CCNCC2)s1
InChIInChI=1S/C10H16N2OS.ClH/c1-3-11-4-2-9(1)6-13-7-10-5-12-8-14-10;/h5,8-9,11H,1-4,6-7H2;1H
InChIKeyQLWUEPRWAICYEM-UHFFFAOYSA-N
XLogP2.08
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.78
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[(3S)-pyrrolidin-3-yl]oxymethyl]-1,3-thiazole
CID 71636911
4-(piperidin-4-ylmethoxymethyl)pyridine;hydrochloride
CID 71637005
1,3-thiazol-5-ylmethyl N-(2-piperidin-4-ylethyl)carbamate
CID 67394506
2-chloro-5-[[(3S)-pyrrolidin-3-yl]methoxymethyl]-1,3-thiazole
CID 97163860
4-[(5-ethylthiophen-2-yl)methoxymethyl]piperidine
CID 62340071
5-(pyrrolidin-3-ylmethylsulfonylmethyl)-1,3-thiazole
CID 71645788
1-pyrrolidin-3-yl-3-(1,3-thiazol-5-yl)propan-2-one
CID 116583454
N-(piperidin-4-ylmethyl)-N-(1,3-thiazol-5-ylmethyl)cyclopropanamine
CID 112641605
5-(piperidin-3-ylmethyl)-1,3-thiazole
CID 112644485
3-(piperidin-4-ylmethoxymethyl)-1,2,4-oxadiazole
CID 62339041
1-cyclopropyl-N-(1,3-thiazol-5-ylmethyl)methanamine;hydrochloride
CID 167715845
3-chloro-6-(piperidin-4-ylmethoxymethyl)pyridazine;hydrochloride
CID 71639908

Frequently Asked Questions

What is the IUPAC name of 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride?
The IUPAC name of 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride (CID 71637010) is 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride.
What is the SMILES notation for 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride?
The canonical SMILES for 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride is Cl.c1ncc(COCC2CCNCC2)s1.
What is the InChIKey of 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride?
The InChIKey is QLWUEPRWAICYEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS.ClH/c1-3-11-4-2-9(1)6-13-7-10-5-12-8-14-10;/h5,8-9,11H,1-4,6-7H2;1H.
What are the key properties of 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride?
5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride has a molecular weight of 248.78 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(piperidin-4-ylmethoxymethyl)-1,3-thiazole;hydrochloride is sourced from PubChem (CID 71637010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).