5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole

C8H10N2S — CID 139358445

IUPAC5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole
SMILESC1=C(c2cncs2)CNCC1
InChIInChI=1S/C8H10N2S/c1-2-7(4-9-3-1)8-5-10-6-11-8/h2,5-6,9H,1,3-4H2
InChIKeyNIBYQOILBHPDLV-UHFFFAOYSA-N
MW166.25 g/mol
LogP1.52
Rot. Bonds1

About 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole

5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole (PubChem CID 139358445) has the molecular formula C8H10N2S and a molecular weight of 166.25 g/mol. Its IUPAC name is 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole.

Molecular Properties

Compound Name5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole
PubChem CID139358445
Molecular FormulaC8H10N2S
Molecular Weight166.25 g/mol
Exact Mass166.06
IUPAC Name5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole
SMILESC1=C(c2cncs2)CNCC1
InChIInChI=1S/C8H10N2S/c1-2-7(4-9-3-1)8-5-10-6-11-8/h2,5-6,9H,1,3-4H2
InChIKeyNIBYQOILBHPDLV-UHFFFAOYSA-N
XLogP1.52
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole with MolForge

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

Launch Full Analysis

Related Compounds

5-(1-propyl-3,6-dihydro-2H-pyridin-5-yl)-1,3-thiazol-2-amine
CID 14510207
4-(1,3-Thiazol-5-yl)-1,2,3,6-tetrahydropyridine dihydrochloride
CID 145994643
5-(1,2,3,6-Tetrahydropyridin-4-yl)-2-(trifluoromethyl)-1,3-thiazole
CID 106784090
5-(2,5-dihydro-1H-pyrrol-3-yl)-2-(trifluoromethyl)-1,3-thiazole
CID 106784091
4-[2-(Trifluoromethyl)-1,3-thiazol-5-yl]pent-3-en-1-amine
CID 106784470
(Z)-N-methyl-4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pent-3-en-1-amine
CID 106784478
(Z)-N-ethyl-4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pent-3-en-1-amine
CID 106784479
(Z)-N-propyl-4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pent-3-en-1-amine
CID 106784480
N-[4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pent-3-enyl]cyclopropanamine
CID 106784481
N-tert-butyl-4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pent-3-en-1-amine
CID 106784482
(Z)-N-(2-methylpropyl)-4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pent-3-en-1-amine
CID 106784483
(Z)-N-propan-2-yl-4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pent-3-en-1-amine
CID 113876871

Frequently Asked Questions

What is the IUPAC name of 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole?
The IUPAC name of 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole (CID 139358445) is 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole.
What is the SMILES notation for 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole?
The canonical SMILES for 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole is C1=C(c2cncs2)CNCC1.
What is the InChIKey of 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole?
The InChIKey is NIBYQOILBHPDLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2S/c1-2-7(4-9-3-1)8-5-10-6-11-8/h2,5-6,9H,1,3-4H2.
What are the key properties of 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole?
5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole has a molecular weight of 166.25 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole is sourced from PubChem (CID 139358445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).