N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide

C14H12F3N3O2S — CID 563455

IUPACN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC1(C(F)(F)F)N=C2SCCN2C1=O
InChIInChI=1S/C14H12F3N3O2S/c15-14(16,17)13(11(22)20-6-7-23-12(20)19-13)18-10(21)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,18,21)
InChIKeyVRASBOKSKFPAFO-UHFFFAOYSA-N
MW343.33 g/mol
LogP1.55
Rot. Bonds3

About N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide

N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide (PubChem CID 563455) has the molecular formula C14H12F3N3O2S and a molecular weight of 343.33 g/mol. Its IUPAC name is N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide
PubChem CID563455
Molecular FormulaC14H12F3N3O2S
Molecular Weight343.33 g/mol
Exact Mass343.06
IUPAC NameN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NC1(C(F)(F)F)N=C2SCCN2C1=O
InChIInChI=1S/C14H12F3N3O2S/c15-14(16,17)13(11(22)20-6-7-23-12(20)19-13)18-10(21)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,18,21)
InChIKeyVRASBOKSKFPAFO-UHFFFAOYSA-N
XLogP1.55
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.33
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide?
The IUPAC name of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide (CID 563455) is N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide.
What is the SMILES notation for N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide?
The canonical SMILES for N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide is O=C(Cc1ccccc1)NC1(C(F)(F)F)N=C2SCCN2C1=O.
What is the InChIKey of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide?
The InChIKey is VRASBOKSKFPAFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3N3O2S/c15-14(16,17)13(11(22)20-6-7-23-12(20)19-13)18-10(21)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,18,21).
What are the key properties of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide?
N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide has a molecular weight of 343.33 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-2-phenylacetamide is sourced from PubChem (CID 563455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).