4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride

C8H11ClN2S — CID 68746715

IUPAC4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride
SMILESC1=C(c2cscn2)CCNC1.Cl
InChIInChI=1S/C8H10N2S.ClH/c1-3-9-4-2-7(1)8-5-11-6-10-8;/h1,5-6,9H,2-4H2;1H
InChIKeyRYAXVIZNCQOILJ-UHFFFAOYSA-N
MW202.71 g/mol
LogP1.94
Rot. Bonds1

About 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride

4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride (PubChem CID 68746715) has the molecular formula C8H11ClN2S and a molecular weight of 202.71 g/mol. Its IUPAC name is 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride.

Molecular Properties

Compound Name4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride
PubChem CID68746715
Molecular FormulaC8H11ClN2S
Molecular Weight202.71 g/mol
Exact Mass202.03
IUPAC Name4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride
SMILESC1=C(c2cscn2)CCNC1.Cl
InChIInChI=1S/C8H10N2S.ClH/c1-3-9-4-2-7(1)8-5-11-6-10-8;/h1,5-6,9H,2-4H2;1H
InChIKeyRYAXVIZNCQOILJ-UHFFFAOYSA-N
XLogP1.94
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.71
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride?
The IUPAC name of 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride (CID 68746715) is 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride.
What is the SMILES notation for 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride?
The canonical SMILES for 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride is C1=C(c2cscn2)CCNC1.Cl.
What is the InChIKey of 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride?
The InChIKey is RYAXVIZNCQOILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2S.ClH/c1-3-9-4-2-7(1)8-5-11-6-10-8;/h1,5-6,9H,2-4H2;1H.
What are the key properties of 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride?
4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride has a molecular weight of 202.71 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2,3,6-tetrahydropyridin-4-yl)-1,3-thiazole;hydrochloride is sourced from PubChem (CID 68746715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).