1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone

C11H17N3OS — CID 142075753

IUPAC1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone
SMILESCCc1cnc(C2CNCCN2C(C)=O)s1
InChIInChI=1S/C11H17N3OS/c1-3-9-6-13-11(16-9)10-7-12-4-5-14(10)8(2)15/h6,10,12H,3-5,7H2,1-2H3
InChIKeyMJEOSNOHTIZDED-UHFFFAOYSA-N
MW239.34 g/mol
LogP1.20
Rot. Bonds2

About 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone

1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone (PubChem CID 142075753) has the molecular formula C11H17N3OS and a molecular weight of 239.34 g/mol. Its IUPAC name is 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone
PubChem CID142075753
Molecular FormulaC11H17N3OS
Molecular Weight239.34 g/mol
Exact Mass239.11
IUPAC Name1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone
SMILESCCc1cnc(C2CNCCN2C(C)=O)s1
InChIInChI=1S/C11H17N3OS/c1-3-9-6-13-11(16-9)10-7-12-4-5-14(10)8(2)15/h6,10,12H,3-5,7H2,1-2H3
InChIKeyMJEOSNOHTIZDED-UHFFFAOYSA-N
XLogP1.20
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.34
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-Cyclopentylpiperidin-4-yl)-3-[(5-ethyl-1,3-thiazol-2-yl)methyl]urea
CID 71862982
1-[(5-Ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-3-(1-methyl-2-oxopyrrolidin-3-yl)urea
CID 71981647
N-(1-(1-(L-alanyl)piperidin-4-yl)ethyl)-5-ethylthiazole-2-carboxamide
CID 132228070
1-{4-[(1,3-Thiazol-5-ylmethyl)amino]piperidin-1-yl}ethan-1-one
CID 62758882
3-Ethyl-1-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methylurea
CID 71981834
1-[(5-Ethyl-1,3-thiazol-2-yl)methyl]-3-[2-(3-methylmorpholin-4-yl)propyl]urea
CID 71989956
N,N-dimethyl-2-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-ylamino]acetamide
CID 86789745
(2S)-2-[2-(5-ethyl-1,3-thiazol-2-yl)ethylcarbamoylamino]-N,N-dimethylpropanamide
CID 86819563
(2S)-2-amino-N-[(2-ethyl-1,3-thiazol-5-yl)methyl]-N,3-dimethylbutanamide
CID 91659790
1-[(1S)-1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-3-[2-(4-methoxypiperidin-1-yl)ethyl]urea
CID 96562963
(3S)-3-(2-methylpropyl)-4-[(5-methyl-1,3-thiazol-2-yl)methyl]piperazin-2-one
CID 164632613
N-[(3S)-1-methyl-6-oxopiperidin-3-yl]-3-(1,3-thiazol-5-yl)propanamide
CID 164639964

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone?
The IUPAC name of 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone (CID 142075753) is 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone.
What is the SMILES notation for 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone?
The canonical SMILES for 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone is CCc1cnc(C2CNCCN2C(C)=O)s1.
What is the InChIKey of 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone?
The InChIKey is MJEOSNOHTIZDED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3OS/c1-3-9-6-13-11(16-9)10-7-12-4-5-14(10)8(2)15/h6,10,12H,3-5,7H2,1-2H3.
What are the key properties of 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone?
1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone has a molecular weight of 239.34 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone is sourced from PubChem (CID 142075753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).