2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide

C8H10F3N3OS — CID 102766050

IUPAC2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCc1ncsc1C(NCC(F)(F)F)C(N)=O
InChIInChI=1S/C8H10F3N3OS/c1-4-6(16-3-14-4)5(7(12)15)13-2-8(9,10)11/h3,5,13H,2H2,1H3,(H2,12,15)
InChIKeyLHIQGCVAIMOQBZ-UHFFFAOYSA-N
MW253.25 g/mol
LogP1.13
Rot. Bonds4

About 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide

2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 102766050) has the molecular formula C8H10F3N3OS and a molecular weight of 253.25 g/mol. Its IUPAC name is 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound Name2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID102766050
Molecular FormulaC8H10F3N3OS
Molecular Weight253.25 g/mol
Exact Mass253.05
IUPAC Name2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCc1ncsc1C(NCC(F)(F)F)C(N)=O
InChIInChI=1S/C8H10F3N3OS/c1-4-6(16-3-14-4)5(7(12)15)13-2-8(9,10)11/h3,5,13H,2H2,1H3,(H2,12,15)
InChIKeyLHIQGCVAIMOQBZ-UHFFFAOYSA-N
XLogP1.13
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.25
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide (CID 102766050) is 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide is Cc1ncsc1C(NCC(F)(F)F)C(N)=O.
What is the InChIKey of 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is LHIQGCVAIMOQBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3OS/c1-4-6(16-3-14-4)5(7(12)15)13-2-8(9,10)11/h3,5,13H,2H2,1H3,(H2,12,15).
What are the key properties of 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide?
2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 253.25 g/mol, XLogP of 1.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-1,3-thiazol-5-yl)-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 102766050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).