3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one

C9H15N3OS — CID 63312548

IUPAC3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one
SMILESO=c1sccn1CCN1CCNCC1
InChIInChI=1S/C9H15N3OS/c13-9-12(7-8-14-9)6-5-11-3-1-10-2-4-11/h7-8,10H,1-6H2
InChIKeyLNJDBGPHPNTFSJ-UHFFFAOYSA-N
MW213.31 g/mol
LogP-0.19
Rot. Bonds3

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

3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one (PubChem CID 63312548) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one.

Molecular Properties

Compound Name3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one
PubChem CID63312548
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one
SMILESO=c1sccn1CCN1CCNCC1
InChIInChI=1S/C9H15N3OS/c13-9-12(7-8-14-9)6-5-11-3-1-10-2-4-11/h7-8,10H,1-6H2
InChIKeyLNJDBGPHPNTFSJ-UHFFFAOYSA-N
XLogP-0.19
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-Aminoethyl)-2,3-dihydro-1,3-thiazol-2-one
CID 63312349
N-[2-(2H-1,3-thiazol-3-yl)ethyl]formamide
CID 87322503
(3-methyl-2H-1,3-thiazol-2-yl)-piperazin-1-ylmethanone
CID 146957017
3-(2-Oxo-2-piperazin-1-ylethyl)-1,3-thiazol-2-one
CID 63312403
3-[2-(Propylamino)ethyl]-1,3-thiazol-2-one
CID 63312458
3-[2-(Propan-2-ylamino)ethyl]-1,3-thiazol-2-one
CID 63312501
3-[2-(Ethylamino)ethyl]-1,3-thiazol-2-one
CID 63312549
3-(Piperidin-2-ylmethyl)-1,3-thiazol-2-one
CID 63312551
3-[2-(Methylamino)ethyl]-1,3-thiazol-2-one
CID 63312602
4-(2-Piperazin-1-ylethyl)-1,4-thiazin-3-one
CID 82509987
3-(2-thiomorpholin-4-ylethyl)-1H-imidazol-2-one
CID 106326461
3-[2-(4-Methylpiperazin-1-yl)ethyl]-1,3-thiazol-2-one
CID 116622649

Frequently Asked Questions

What is the IUPAC name of 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one?
The IUPAC name of 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one (CID 63312548) is 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one.
What is the SMILES notation for 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one?
The canonical SMILES for 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one is O=c1sccn1CCN1CCNCC1.
What is the InChIKey of 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one?
The InChIKey is LNJDBGPHPNTFSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c13-9-12(7-8-14-9)6-5-11-3-1-10-2-4-11/h7-8,10H,1-6H2.
What are the key properties of 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one?
3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one has a molecular weight of 213.31 g/mol, XLogP of -0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-piperazin-1-ylethyl)-1,3-thiazol-2-one is sourced from PubChem (CID 63312548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).