1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone

C15H16FN3OS — CID 62757449

IUPAC1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone
SMILESCC(=O)c1cnc(N2CCN(c3ccc(F)cc3)CC2)s1
InChIInChI=1S/C15H16FN3OS/c1-11(20)14-10-17-15(21-14)19-8-6-18(7-9-19)13-4-2-12(16)3-5-13/h2-5,10H,6-9H2,1H3
InChIKeyFZCGJZXAASMXGX-UHFFFAOYSA-N
MW305.38 g/mol
LogP2.81
Rot. Bonds3

About 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone

1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone (PubChem CID 62757449) has the molecular formula C15H16FN3OS and a molecular weight of 305.38 g/mol. Its IUPAC name is 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone.

Molecular Properties

Compound Name1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone
PubChem CID62757449
Molecular FormulaC15H16FN3OS
Molecular Weight305.38 g/mol
Exact Mass305.10
IUPAC Name1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone
SMILESCC(=O)c1cnc(N2CCN(c3ccc(F)cc3)CC2)s1
InChIInChI=1S/C15H16FN3OS/c1-11(20)14-10-17-15(21-14)19-8-6-18(7-9-19)13-4-2-12(16)3-5-13/h2-5,10H,6-9H2,1H3
InChIKeyFZCGJZXAASMXGX-UHFFFAOYSA-N
XLogP2.81
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone 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

1-(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)ethanone
CID 62756912
1-[2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone
CID 62757440
1-(4-acetylpiperazin-1-yl)-2-[4-(4-fluorophenyl)piperazin-1-yl]ethane-1,2-dione
CID 108508298
[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]-(4-fluorophenyl)methanone
CID 136528222
2-[4-(1H-pyrazol-4-yl)piperazin-1-yl]-1,3-thiazole-5-carboxamide
CID 175864765
2-[4-(3-chlorophenyl)piperazin-1-yl]-1,3-thiazole-5-carboxylic acid
CID 62753823
1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one
CID 3659016
1-[4-[4-(2-bromo-1,3-thiazole-5-carbonyl)piperazin-1-yl]phenyl]ethanone
CID 167770167
2-(4-hydroxypiperidin-1-yl)-1,3-thiazole-5-carboxylic acid
CID 71208672
2,2,2-trifluoro-1-(2-piperazin-1-yl-1,3-thiazol-5-yl)ethanone
CID 141447757
N-methyl-2-piperazin-1-yl-1,3-thiazole-5-carboxamide
CID 83579539
2-(4-fluorophenoxy)-1-[4-(5-methyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone
CID 133309355

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone?
The IUPAC name of 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone (CID 62757449) is 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone.
What is the SMILES notation for 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone?
The canonical SMILES for 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone is CC(=O)c1cnc(N2CCN(c3ccc(F)cc3)CC2)s1.
What is the InChIKey of 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone?
The InChIKey is FZCGJZXAASMXGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3OS/c1-11(20)14-10-17-15(21-14)19-8-6-18(7-9-19)13-4-2-12(16)3-5-13/h2-5,10H,6-9H2,1H3.
What are the key properties of 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone?
1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone has a molecular weight of 305.38 g/mol, XLogP of 2.81, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1,3-thiazol-5-yl]ethanone is sourced from PubChem (CID 62757449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).