N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide

C11H10F3N3OS2 — CID 84560322

IUPACN-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
SMILESCC(C)c1csc(NC(=O)c2scnc2C(F)(F)F)n1
InChIInChI=1S/C11H10F3N3OS2/c1-5(2)6-3-19-10(16-6)17-9(18)7-8(11(12,13)14)15-4-20-7/h3-5H,1-2H3,(H,16,17,18)
InChIKeyQAGSCJGUEOSTKI-UHFFFAOYSA-N
MW321.35 g/mol
LogP3.99
Rot. Bonds3

About N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide

N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide (PubChem CID 84560322) has the molecular formula C11H10F3N3OS2 and a molecular weight of 321.35 g/mol. Its IUPAC name is N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
PubChem CID84560322
Molecular FormulaC11H10F3N3OS2
Molecular Weight321.35 g/mol
Exact Mass321.02
IUPAC NameN-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
SMILESCC(C)c1csc(NC(=O)c2scnc2C(F)(F)F)n1
InChIInChI=1S/C11H10F3N3OS2/c1-5(2)6-3-19-10(16-6)17-9(18)7-8(11(12,13)14)15-4-20-7/h3-5H,1-2H3,(H,16,17,18)
InChIKeyQAGSCJGUEOSTKI-UHFFFAOYSA-N
XLogP3.99
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.35
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-4-methyl-1,3-thiazole-5-carboxamide
CID 47046086
4-(difluoromethyl)-N-(4-ethyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide
CID 135153561
N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 84560383
N-(5-methyl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 84560475
N-(1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 84561344
N-(4-methyl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 84561345
4-methyl-N-(1,3-thiazol-2-yl)-2-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 110676711
4-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 110676720
4-Methyl-2-[[[4-(trifluoromethyl)-1,3-thiazol-2-yl]amino]methyl]-1,3-thiazole-5-carboxamide
CID 131963983
N-(3-tert-butyl-1,2,4-thiadiazol-5-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
CID 146130715
2-amino-4-methyl-N-(thiazol-2-yl)thiazole-5-carboxamide
CID 948473
2-[2-[(4-Methyl-1,3-thiazole-5-carbonyl)amino]-1,3-thiazol-4-yl]acetic acid
CID 18071971

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide (CID 84560322) is N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide is CC(C)c1csc(NC(=O)c2scnc2C(F)(F)F)n1.
What is the InChIKey of N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide?
The InChIKey is QAGSCJGUEOSTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3OS2/c1-5(2)6-3-19-10(16-6)17-9(18)7-8(11(12,13)14)15-4-20-7/h3-5H,1-2H3,(H,16,17,18).
What are the key properties of N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide?
N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide has a molecular weight of 321.35 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 84560322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).