N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide

C6H6F3N3OS — CID 166873079

IUPACN-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(C(F)(F)F)c(N)s1
InChIInChI=1S/C6H6F3N3OS/c1-2(13)11-5-12-3(4(10)14-5)6(7,8)9/h10H2,1H3,(H,11,12,13)
InChIKeyWHRGUPMACJEDTH-UHFFFAOYSA-N
MW225.19 g/mol
LogP1.70
Rot. Bonds1

About N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide

N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 166873079) has the molecular formula C6H6F3N3OS and a molecular weight of 225.19 g/mol. Its IUPAC name is N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
PubChem CID166873079
Molecular FormulaC6H6F3N3OS
Molecular Weight225.19 g/mol
Exact Mass225.02
IUPAC NameN-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(C(F)(F)F)c(N)s1
InChIInChI=1S/C6H6F3N3OS/c1-2(13)11-5-12-3(4(10)14-5)6(7,8)9/h10H2,1H3,(H,11,12,13)
InChIKeyWHRGUPMACJEDTH-UHFFFAOYSA-N
XLogP1.70
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.19
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Acetamide, N-(4-(trifluoromethyl)-2-thiazolyl)-
CID 1229692
2,2,2-trifluoro-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 1229693
N-(5-Iodo-4-methyl-2-thiazolyl)acetamide
CID 57417074
2,2,2-trifluoro-N-[4-(trifluoromethyl)-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-yl]acetamide
CID 21780306
N-[5-nitro-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
CID 12393070
N-[5-(difluoromethyl)-4-(trifluoromethyl)-1,3-thiazol-2-yl]-2,2,2-trifluoroacetamide
CID 15710711
N-(5-bromo-4-methyl-1,3-thiazol-2-yl)-2,2,2-trifluoroacetamide
CID 12954382
N-[4-(difluoromethyl)-1,3-thiazol-2-yl]acetamide
CID 155193876
N-[4-(difluoromethyl)-5-iodo-1,3-thiazol-2-yl]acetamide
CID 155193936
N-(5-Chloro-4-(trifluoromethyl)-1,3-thiazol-2-yl)acetamide
CID 178198
N-(4,5-dimethylthiazol-2-yl)-2,2,2-trifluoroacetamide
CID 5224505
N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propanamide
CID 45883360

Frequently Asked Questions

What is the IUPAC name of N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide (CID 166873079) is N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1nc(C(F)(F)F)c(N)s1.
What is the InChIKey of N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is WHRGUPMACJEDTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F3N3OS/c1-2(13)11-5-12-3(4(10)14-5)6(7,8)9/h10H2,1H3,(H,11,12,13).
What are the key properties of N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide?
N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 225.19 g/mol, XLogP of 1.70, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-amino-4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 166873079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).