5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride

C9H15ClN2S — CID 162328120

IUPAC5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride
SMILESCc1cnc(C2CCNCC2)s1.Cl
InChIInChI=1S/C9H14N2S.ClH/c1-7-6-11-9(12-7)8-2-4-10-5-3-8;/h6,8,10H,2-5H2,1H3;1H
InChIKeyWGJCPMCMKMOOOB-UHFFFAOYSA-N
MW218.75 g/mol
LogP2.34
Rot. Bonds1

About 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride

5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride (PubChem CID 162328120) has the molecular formula C9H15ClN2S and a molecular weight of 218.75 g/mol. Its IUPAC name is 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride.

Molecular Properties

Compound Name5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride
PubChem CID162328120
Molecular FormulaC9H15ClN2S
Molecular Weight218.75 g/mol
Exact Mass218.06
IUPAC Name5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride
SMILESCc1cnc(C2CCNCC2)s1.Cl
InChIInChI=1S/C9H14N2S.ClH/c1-7-6-11-9(12-7)8-2-4-10-5-3-8;/h6,8,10H,2-5H2,1H3;1H
InChIKeyWGJCPMCMKMOOOB-UHFFFAOYSA-N
XLogP2.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.75
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride?
The IUPAC name of 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride (CID 162328120) is 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride.
What is the SMILES notation for 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride?
The canonical SMILES for 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride is Cc1cnc(C2CCNCC2)s1.Cl.
What is the InChIKey of 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride?
The InChIKey is WGJCPMCMKMOOOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S.ClH/c1-7-6-11-9(12-7)8-2-4-10-5-3-8;/h6,8,10H,2-5H2,1H3;1H.
What are the key properties of 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride?
5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride has a molecular weight of 218.75 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride is sourced from PubChem (CID 162328120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).