N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide

C11H18N4O3S2 — CID 27242032

IUPACN-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide
SMILESCCN1CCN(S(=O)(=O)c2cnc(NC(C)=O)s2)CC1
InChIInChI=1S/C11H18N4O3S2/c1-3-14-4-6-15(7-5-14)20(17,18)10-8-12-11(19-10)13-9(2)16/h8H,3-7H2,1-2H3,(H,12,13,16)
InChIKeyWXLIDIAOMHZSEU-UHFFFAOYSA-N
MW318.42 g/mol
LogP0.43
Rot. Bonds4

About N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide

N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide (PubChem CID 27242032) has the molecular formula C11H18N4O3S2 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide
PubChem CID27242032
Molecular FormulaC11H18N4O3S2
Molecular Weight318.42 g/mol
Exact Mass318.08
IUPAC NameN-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide
SMILESCCN1CCN(S(=O)(=O)c2cnc(NC(C)=O)s2)CC1
InChIInChI=1S/C11H18N4O3S2/c1-3-14-4-6-15(7-5-14)20(17,18)10-8-12-11(19-10)13-9(2)16/h8H,3-7H2,1-2H3,(H,12,13,16)
InChIKeyWXLIDIAOMHZSEU-UHFFFAOYSA-N
XLogP0.43
TPSA82.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-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-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide (CID 27242032) is N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide is CCN1CCN(S(=O)(=O)c2cnc(NC(C)=O)s2)CC1.
What is the InChIKey of N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide?
The InChIKey is WXLIDIAOMHZSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S2/c1-3-14-4-6-15(7-5-14)20(17,18)10-8-12-11(19-10)13-9(2)16/h8H,3-7H2,1-2H3,(H,12,13,16).
What are the key properties of N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide?
N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide has a molecular weight of 318.42 g/mol, XLogP of 0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-ethylpiperazin-1-yl)sulfonyl-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 27242032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).