2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone

C10H15N3OS — CID 82509786

IUPAC2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone
SMILESCc1ncc(CC(=O)N2CCNCC2)s1
InChIInChI=1S/C10H15N3OS/c1-8-12-7-9(15-8)6-10(14)13-4-2-11-3-5-13/h7,11H,2-6H2,1H3
InChIKeyMPTKQBJGFCVNKK-UHFFFAOYSA-N
MW225.32 g/mol
LogP0.43
Rot. Bonds2

About 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone

2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone (PubChem CID 82509786) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone.

Molecular Properties

Compound Name2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone
PubChem CID82509786
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone
SMILESCc1ncc(CC(=O)N2CCNCC2)s1
InChIInChI=1S/C10H15N3OS/c1-8-12-7-9(15-8)6-10(14)13-4-2-11-3-5-13/h7,11H,2-6H2,1H3
InChIKeyMPTKQBJGFCVNKK-UHFFFAOYSA-N
XLogP0.43
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone 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 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone?
The IUPAC name of 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone (CID 82509786) is 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone.
What is the SMILES notation for 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone?
The canonical SMILES for 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone is Cc1ncc(CC(=O)N2CCNCC2)s1.
What is the InChIKey of 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone?
The InChIKey is MPTKQBJGFCVNKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-8-12-7-9(15-8)6-10(14)13-4-2-11-3-5-13/h7,11H,2-6H2,1H3.
What are the key properties of 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone?
2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone has a molecular weight of 225.32 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1,3-thiazol-5-yl)-1-piperazin-1-ylethanone is sourced from PubChem (CID 82509786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).