N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide

C14H18N4O4S2 — CID 4968285

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide
SMILESCc1cc(NC(=O)CN2CCN(S(=O)(=O)c3cccs3)CC2)no1
InChIInChI=1S/C14H18N4O4S2/c1-11-9-12(16-22-11)15-13(19)10-17-4-6-18(7-5-17)24(20,21)14-3-2-8-23-14/h2-3,8-9H,4-7,10H2,1H3,(H,15,16,19)
InChIKeySIUOZVTXZQQABR-UHFFFAOYSA-N
MW370.46 g/mol
LogP0.99
Rot. Bonds5

About N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide

N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide (PubChem CID 4968285) has the molecular formula C14H18N4O4S2 and a molecular weight of 370.46 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide
PubChem CID4968285
Molecular FormulaC14H18N4O4S2
Molecular Weight370.46 g/mol
Exact Mass370.08
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide
SMILESCc1cc(NC(=O)CN2CCN(S(=O)(=O)c3cccs3)CC2)no1
InChIInChI=1S/C14H18N4O4S2/c1-11-9-12(16-22-11)15-13(19)10-17-4-6-18(7-5-17)24(20,21)14-3-2-8-23-14/h2-3,8-9H,4-7,10H2,1H3,(H,15,16,19)
InChIKeySIUOZVTXZQQABR-UHFFFAOYSA-N
XLogP0.99
TPSA95.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-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

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide (CID 4968285) is N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide is Cc1cc(NC(=O)CN2CCN(S(=O)(=O)c3cccs3)CC2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide?
The InChIKey is SIUOZVTXZQQABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O4S2/c1-11-9-12(16-22-11)15-13(19)10-17-4-6-18(7-5-17)24(20,21)14-3-2-8-23-14/h2-3,8-9H,4-7,10H2,1H3,(H,15,16,19).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide has a molecular weight of 370.46 g/mol, XLogP of 0.99, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetamide is sourced from PubChem (CID 4968285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).