4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole

C14H19N3OS — CID 63342295

IUPAC4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole
SMILESCc1ccc(-c2csc(C(C)N3CCNCC3)n2)o1
InChIInChI=1S/C14H19N3OS/c1-10-3-4-13(18-10)12-9-19-14(16-12)11(2)17-7-5-15-6-8-17/h3-4,9,11,15H,5-8H2,1-2H3
InChIKeyARNCTKOWUHKTQM-UHFFFAOYSA-N
MW277.39 g/mol
LogP2.68
Rot. Bonds3

About 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole

4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole (PubChem CID 63342295) has the molecular formula C14H19N3OS and a molecular weight of 277.39 g/mol. Its IUPAC name is 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole
PubChem CID63342295
Molecular FormulaC14H19N3OS
Molecular Weight277.39 g/mol
Exact Mass277.12
IUPAC Name4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole
SMILESCc1ccc(-c2csc(C(C)N3CCNCC3)n2)o1
InChIInChI=1S/C14H19N3OS/c1-10-3-4-13(18-10)12-9-19-14(16-12)11(2)17-7-5-15-6-8-17/h3-4,9,11,15H,5-8H2,1-2H3
InChIKeyARNCTKOWUHKTQM-UHFFFAOYSA-N
XLogP2.68
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-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

4-(5-chlorothiophen-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole
CID 63342467
2,5-dimethyl-4-[2-(1-piperazin-1-ylethyl)-1,3-thiazol-4-yl]-1,3-thiazole
CID 63751900
4-(5-methylfuran-2-yl)-2-(piperazin-1-ylmethyl)-1,3-thiazole
CID 63333142
4-(3-fluorophenyl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole
CID 63342291
2-bromo-4-(5-methylfuran-2-yl)-1,3-thiazole
CID 112623649
3-amino-3-[4-(5-methylfuran-2-yl)-1,3-thiazol-2-yl]propanoic acid
CID 116966881
4-phenyl-2-(1-piperazin-1-ylpropyl)-1,3-thiazole
CID 63342212
2-(1-piperazin-1-ylethyl)-[1,3]thiazolo[5,4-b]pyridine
CID 65335839
1-[1-(2-methylpyrazol-3-yl)ethyl]piperazine
CID 83830839
1-[(1R)-1-(5-methylfuran-2-yl)prop-2-enyl]piperazine;dihydrochloride
CID 171294318
2,5-dimethyl-4-[2-(1-piperazin-1-ylpropyl)-1,3-thiazol-4-yl]-1,3-thiazole
CID 63752075
4-(5-methylfuran-2-yl)-2-(1-methylpiperazin-2-yl)pyrimidine
CID 116901849

Frequently Asked Questions

What is the IUPAC name of 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole?
The IUPAC name of 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole (CID 63342295) is 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole.
What is the SMILES notation for 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole?
The canonical SMILES for 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole is Cc1ccc(-c2csc(C(C)N3CCNCC3)n2)o1.
What is the InChIKey of 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole?
The InChIKey is ARNCTKOWUHKTQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3OS/c1-10-3-4-13(18-10)12-9-19-14(16-12)11(2)17-7-5-15-6-8-17/h3-4,9,11,15H,5-8H2,1-2H3.
What are the key properties of 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole?
4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole has a molecular weight of 277.39 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methylfuran-2-yl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole is sourced from PubChem (CID 63342295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).