N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide

C9H14N2O3S — CID 33101559

IUPACN-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide
SMILESCONC(=O)CCCn1c(C)csc1=O
InChIInChI=1S/C9H14N2O3S/c1-7-6-15-9(13)11(7)5-3-4-8(12)10-14-2/h6H,3-5H2,1-2H3,(H,10,12)
InChIKeyGWRMWVOMNVFQAS-UHFFFAOYSA-N
MW230.29 g/mol
LogP0.68
Rot. Bonds5

About N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide

N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide (PubChem CID 33101559) has the molecular formula C9H14N2O3S and a molecular weight of 230.29 g/mol. Its IUPAC name is N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide.

Molecular Properties

Compound NameN-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide
PubChem CID33101559
Molecular FormulaC9H14N2O3S
Molecular Weight230.29 g/mol
Exact Mass230.07
IUPAC NameN-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide
SMILESCONC(=O)CCCn1c(C)csc1=O
InChIInChI=1S/C9H14N2O3S/c1-7-6-15-9(13)11(7)5-3-4-8(12)10-14-2/h6H,3-5H2,1-2H3,(H,10,12)
InChIKeyGWRMWVOMNVFQAS-UHFFFAOYSA-N
XLogP0.68
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide 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-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide?
The IUPAC name of N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide (CID 33101559) is N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide.
What is the SMILES notation for N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide?
The canonical SMILES for N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide is CONC(=O)CCCn1c(C)csc1=O.
What is the InChIKey of N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide?
The InChIKey is GWRMWVOMNVFQAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3S/c1-7-6-15-9(13)11(7)5-3-4-8(12)10-14-2/h6H,3-5H2,1-2H3,(H,10,12).
What are the key properties of N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide?
N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide has a molecular weight of 230.29 g/mol, XLogP of 0.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide is sourced from PubChem (CID 33101559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).