N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide

C9H13N3O3S — CID 71601399

IUPACN-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide
SMILESO=C(CC1SC(N2CCCC2)=NC1=O)NO
InChIInChI=1S/C9H13N3O3S/c13-7(11-15)5-6-8(14)10-9(16-6)12-3-1-2-4-12/h6,15H,1-5H2,(H,11,13)
InChIKeyAFKLEVSACXFIQN-UHFFFAOYSA-N
MW243.29 g/mol
LogP-0.02
Rot. Bonds2

About N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide

N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide (PubChem CID 71601399) has the molecular formula C9H13N3O3S and a molecular weight of 243.29 g/mol. Its IUPAC name is N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide.

Molecular Properties

Compound NameN-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide
PubChem CID71601399
Molecular FormulaC9H13N3O3S
Molecular Weight243.29 g/mol
Exact Mass243.07
IUPAC NameN-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide
SMILESO=C(CC1SC(N2CCCC2)=NC1=O)NO
InChIInChI=1S/C9H13N3O3S/c13-7(11-15)5-6-8(14)10-9(16-6)12-3-1-2-4-12/h6,15H,1-5H2,(H,11,13)
InChIKeyAFKLEVSACXFIQN-UHFFFAOYSA-N
XLogP-0.02
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide?
The IUPAC name of N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide (CID 71601399) is N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide.
What is the SMILES notation for N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide?
The canonical SMILES for N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide is O=C(CC1SC(N2CCCC2)=NC1=O)NO.
What is the InChIKey of N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide?
The InChIKey is AFKLEVSACXFIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3S/c13-7(11-15)5-6-8(14)10-9(16-6)12-3-1-2-4-12/h6,15H,1-5H2,(H,11,13).
What are the key properties of N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide?
N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide has a molecular weight of 243.29 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-(4-oxo-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)acetamide is sourced from PubChem (CID 71601399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).