2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide

C10H14N4O3S — CID 11558091

IUPAC2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide
SMILESCC(=O)N1CCN(c2ncc(C(=O)NO)s2)CC1
InChIInChI=1S/C10H14N4O3S/c1-7(15)13-2-4-14(5-3-13)10-11-6-8(18-10)9(16)12-17/h6,17H,2-5H2,1H3,(H,12,16)
InChIKeyVBVYLNNSKNPOQV-UHFFFAOYSA-N
MW270.31 g/mol
LogP-0.07
Rot. Bonds2

About 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide

2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide (PubChem CID 11558091) has the molecular formula C10H14N4O3S and a molecular weight of 270.31 g/mol. Its IUPAC name is 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide
PubChem CID11558091
Molecular FormulaC10H14N4O3S
Molecular Weight270.31 g/mol
Exact Mass270.08
IUPAC Name2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide
SMILESCC(=O)N1CCN(c2ncc(C(=O)NO)s2)CC1
InChIInChI=1S/C10H14N4O3S/c1-7(15)13-2-4-14(5-3-13)10-11-6-8(18-10)9(16)12-17/h6,17H,2-5H2,1H3,(H,12,16)
InChIKeyVBVYLNNSKNPOQV-UHFFFAOYSA-N
XLogP-0.07
TPSA85.77 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide 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 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide (CID 11558091) is 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide is CC(=O)N1CCN(c2ncc(C(=O)NO)s2)CC1.
What is the InChIKey of 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide?
The InChIKey is VBVYLNNSKNPOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O3S/c1-7(15)13-2-4-14(5-3-13)10-11-6-8(18-10)9(16)12-17/h6,17H,2-5H2,1H3,(H,12,16).
What are the key properties of 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide?
2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide has a molecular weight of 270.31 g/mol, XLogP of -0.07, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperazin-1-yl)-N-hydroxy-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 11558091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).