4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one

C10H15N3O2S — CID 43287107

IUPAC4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one
SMILESCc1csc(=O)n1CC(=O)N1CCNCC1
InChIInChI=1S/C10H15N3O2S/c1-8-7-16-10(15)13(8)6-9(14)12-4-2-11-3-5-12/h7,11H,2-6H2,1H3
InChIKeyIZMFFAVDTOKMMI-UHFFFAOYSA-N
MW241.32 g/mol
LogP-0.35
Rot. Bonds2

About 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one

4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one (PubChem CID 43287107) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one.

Molecular Properties

Compound Name4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one
PubChem CID43287107
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one
SMILESCc1csc(=O)n1CC(=O)N1CCNCC1
InChIInChI=1S/C10H15N3O2S/c1-8-7-16-10(15)13(8)6-9(14)12-4-2-11-3-5-12/h7,11H,2-6H2,1H3
InChIKeyIZMFFAVDTOKMMI-UHFFFAOYSA-N
XLogP-0.35
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 5-0.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylbutan-2-yl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 16272650
2-[2-oxo-4-(trifluoromethyl)-1,3-thiazol-3-yl]-N-propan-2-ylacetamide
CID 71979625
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2-sulfanylethyl)acetamide
CID 177680509
N-ethyl-2-oxo-3H-1,3-thiazole-4-carboxamide
CID 123394572
N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide
CID 129309953
(3-methyl-2H-1,3-thiazol-2-yl)-piperazin-1-ylmethanone
CID 146957017
n-Isobutyl-2-(4-methyl-2-oxothiazol-3(2h)-yl)acetamide
CID 16381129
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide
CID 16384335
N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide
CID 17401099
N-(3-methylbutan-2-yl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 17461015
N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 18118143
N-ethyl-2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetamide
CID 18145744

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one?
The IUPAC name of 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one (CID 43287107) is 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one.
What is the SMILES notation for 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one?
The canonical SMILES for 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one is Cc1csc(=O)n1CC(=O)N1CCNCC1.
What is the InChIKey of 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one?
The InChIKey is IZMFFAVDTOKMMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c1-8-7-16-10(15)13(8)6-9(14)12-4-2-11-3-5-12/h7,11H,2-6H2,1H3.
What are the key properties of 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one?
4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one has a molecular weight of 241.32 g/mol, XLogP of -0.35, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one is sourced from PubChem (CID 43287107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).