N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide

C8H10N2O2S — CID 20517178

IUPACN-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESCC(=O)N(C)C(C=O)c1nccs1
InChIInChI=1S/C8H10N2O2S/c1-6(12)10(2)7(5-11)8-9-3-4-13-8/h3-5,7H,1-2H3
InChIKeyLOPGATGVDVXUJE-UHFFFAOYSA-N
MW198.25 g/mol
LogP0.86
Rot. Bonds3

About N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide

N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide (PubChem CID 20517178) has the molecular formula C8H10N2O2S and a molecular weight of 198.25 g/mol. Its IUPAC name is N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide
PubChem CID20517178
Molecular FormulaC8H10N2O2S
Molecular Weight198.25 g/mol
Exact Mass198.05
IUPAC NameN-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide
SMILESCC(=O)N(C)C(C=O)c1nccs1
InChIInChI=1S/C8H10N2O2S/c1-6(12)10(2)7(5-11)8-9-3-4-13-8/h3-5,7H,1-2H3
InChIKeyLOPGATGVDVXUJE-UHFFFAOYSA-N
XLogP0.86
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.25
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-N-[2-(1,3-thiazol-2-yl)ethyl]propanamide
CID 71910308
N,N-Diethyl-2-thiazolecarboxamide
CID 110695970
N-methyl-3-(oxazinan-2-yl)-N-[(1S)-1-(1,3-thiazol-2-yl)ethyl]propanamide
CID 52388414
3,3,3-trifluoro-N-propan-2-yl-N-[2-(1,3-thiazol-2-yl)ethyl]propanamide
CID 122160091
2-Fluoro-2-[4-(1,3-thiazole-2-carbonyl)piperazin-1-yl]propanal
CID 174656226
2-Amino-2-(1,3-thiazol-2-yl)acetaldehyde
CID 20492658
2-Amino-2-(1,3-thiazol-2-yl)acetaldehyde;hydrochloride
CID 21927750
2-Propoxyimino-2-(1,3-thiazol-2-yl)acetaldehyde
CID 53649817
Et-DL-N(Me)Ala-DL-N(Me)Ala-N(Me)Aib-thiazol-2-yl
CID 53662801
N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]formamide
CID 53717124
2-Methoxyimino-2-(1,3-thiazol-2-yl)acetaldehyde
CID 53856160
2-Formamido-2-(1,3-thiazol-2-yl)acetamide
CID 53914176

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide?
The IUPAC name of N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide (CID 20517178) is N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide.
What is the SMILES notation for N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide?
The canonical SMILES for N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide is CC(=O)N(C)C(C=O)c1nccs1.
What is the InChIKey of N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide?
The InChIKey is LOPGATGVDVXUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2S/c1-6(12)10(2)7(5-11)8-9-3-4-13-8/h3-5,7H,1-2H3.
What are the key properties of N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide?
N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide has a molecular weight of 198.25 g/mol, XLogP of 0.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-oxo-1-(1,3-thiazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 20517178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).