N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide

C17H24N4O2S — CID 24626986

IUPACN-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide
SMILESCC(C)c1cc(NC(=O)CN2CCN(Cc3cccs3)CC2)on1
InChIInChI=1S/C17H24N4O2S/c1-13(2)15-10-17(23-19-15)18-16(22)12-21-7-5-20(6-8-21)11-14-4-3-9-24-14/h3-4,9-10,13H,5-8,11-12H2,1-2H3,(H,18,22)
InChIKeyACGNYIUWKPJURL-UHFFFAOYSA-N
MW348.47 g/mol
LogP2.62
Rot. Bonds6

About N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide

N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide (PubChem CID 24626986) has the molecular formula C17H24N4O2S and a molecular weight of 348.47 g/mol. Its IUPAC name is N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide
PubChem CID24626986
Molecular FormulaC17H24N4O2S
Molecular Weight348.47 g/mol
Exact Mass348.16
IUPAC NameN-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide
SMILESCC(C)c1cc(NC(=O)CN2CCN(Cc3cccs3)CC2)on1
InChIInChI=1S/C17H24N4O2S/c1-13(2)15-10-17(23-19-15)18-16(22)12-21-7-5-20(6-8-21)11-14-4-3-9-24-14/h3-4,9-10,13H,5-8,11-12H2,1-2H3,(H,18,22)
InChIKeyACGNYIUWKPJURL-UHFFFAOYSA-N
XLogP2.62
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.47
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide 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

2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 60689757
2-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 30891247
2-(4-methylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 17395553
N-(3,5-dimethylphenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide
CID 8720543
2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 38126163
N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104392
2-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 103728328
N-(5-chloro-2-fluorophenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide
CID 8720879
methyl 4-(thiophen-2-ylmethyl)piperazine-1-carboxylate
CID 110709201
2-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 30890859
N-propan-2-yl-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide
CID 17185587
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide
CID 24594716

Frequently Asked Questions

What is the IUPAC name of N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide (CID 24626986) is N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide is CC(C)c1cc(NC(=O)CN2CCN(Cc3cccs3)CC2)on1.
What is the InChIKey of N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide?
The InChIKey is ACGNYIUWKPJURL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2S/c1-13(2)15-10-17(23-19-15)18-16(22)12-21-7-5-20(6-8-21)11-14-4-3-9-24-14/h3-4,9-10,13H,5-8,11-12H2,1-2H3,(H,18,22).
What are the key properties of N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide?
N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide has a molecular weight of 348.47 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 24626986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).