N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide

C16H16F3N3O3S — CID 4033942

IUPACN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide
SMILESCC(C)Oc1ccc(C(=O)NC2(C(F)(F)F)N=C3SCCN3C2=O)cc1
InChIInChI=1S/C16H16F3N3O3S/c1-9(2)25-11-5-3-10(4-6-11)12(23)20-15(16(17,18)19)13(24)22-7-8-26-14(22)21-15/h3-6,9H,7-8H2,1-2H3,(H,20,23)
InChIKeyJZRBOJXPDWLSLY-UHFFFAOYSA-N
MW387.38 g/mol
LogP2.41
Rot. Bonds4

About N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide

N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide (PubChem CID 4033942) has the molecular formula C16H16F3N3O3S and a molecular weight of 387.38 g/mol. Its IUPAC name is N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide
PubChem CID4033942
Molecular FormulaC16H16F3N3O3S
Molecular Weight387.38 g/mol
Exact Mass387.09
IUPAC NameN-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide
SMILESCC(C)Oc1ccc(C(=O)NC2(C(F)(F)F)N=C3SCCN3C2=O)cc1
InChIInChI=1S/C16H16F3N3O3S/c1-9(2)25-11-5-3-10(4-6-11)12(23)20-15(16(17,18)19)13(24)22-7-8-26-14(22)21-15/h3-6,9H,7-8H2,1-2H3,(H,20,23)
InChIKeyJZRBOJXPDWLSLY-UHFFFAOYSA-N
XLogP2.41
TPSA71.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.38
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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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]-4-propan-2-yloxybenzamide?
The IUPAC name of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide (CID 4033942) is N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide.
What is the SMILES notation for N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide?
The canonical SMILES for N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide is CC(C)Oc1ccc(C(=O)NC2(C(F)(F)F)N=C3SCCN3C2=O)cc1.
What is the InChIKey of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide?
The InChIKey is JZRBOJXPDWLSLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F3N3O3S/c1-9(2)25-11-5-3-10(4-6-11)12(23)20-15(16(17,18)19)13(24)22-7-8-26-14(22)21-15/h3-6,9H,7-8H2,1-2H3,(H,20,23).
What are the key properties of N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide?
N-[5-oxo-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl]-4-propan-2-yloxybenzamide has a molecular weight of 387.38 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 5 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]-4-propan-2-yloxybenzamide is sourced from PubChem (CID 4033942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).