N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide

C10H13F3N2O2S — CID 78858739

IUPACN-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCN(CC(F)(F)F)C(=O)Cn1c(C)csc1=O
InChIInChI=1S/C10H13F3N2O2S/c1-3-14(6-10(11,12)13)8(16)4-15-7(2)5-18-9(15)17/h5H,3-4,6H2,1-2H3
InChIKeyADHBGRGMHGPBHG-UHFFFAOYSA-N
MW282.29 g/mol
LogP1.63
Rot. Bonds4

About N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide

N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 78858739) has the molecular formula C10H13F3N2O2S and a molecular weight of 282.29 g/mol. Its IUPAC name is N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID78858739
Molecular FormulaC10H13F3N2O2S
Molecular Weight282.29 g/mol
Exact Mass282.06
IUPAC NameN-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCN(CC(F)(F)F)C(=O)Cn1c(C)csc1=O
InChIInChI=1S/C10H13F3N2O2S/c1-3-14(6-10(11,12)13)8(16)4-15-7(2)5-18-9(15)17/h5H,3-4,6H2,1-2H3
InChIKeyADHBGRGMHGPBHG-UHFFFAOYSA-N
XLogP1.63
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.29
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide (CID 78858739) is N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide is CCN(CC(F)(F)F)C(=O)Cn1c(C)csc1=O.
What is the InChIKey of N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is ADHBGRGMHGPBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2O2S/c1-3-14(6-10(11,12)13)8(16)4-15-7(2)5-18-9(15)17/h5H,3-4,6H2,1-2H3.
What are the key properties of N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide?
N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 282.29 g/mol, XLogP of 1.63, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 78858739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).