N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

C10H11F2N3O2S — CID 103770471

IUPACN-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESO=C(Cc1cn2ccsc2n1)NCC(O)C(F)F
InChIInChI=1S/C10H11F2N3O2S/c11-9(12)7(16)4-13-8(17)3-6-5-15-1-2-18-10(15)14-6/h1-2,5,7,9,16H,3-4H2,(H,13,17)
InChIKeyNPZHYQAWBPWFGA-UHFFFAOYSA-N
MW275.28 g/mol
LogP0.68
Rot. Bonds5

About N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (PubChem CID 103770471) has the molecular formula C10H11F2N3O2S and a molecular weight of 275.28 g/mol. Its IUPAC name is N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.

Molecular Properties

Compound NameN-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
PubChem CID103770471
Molecular FormulaC10H11F2N3O2S
Molecular Weight275.28 g/mol
Exact Mass275.05
IUPAC NameN-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESO=C(Cc1cn2ccsc2n1)NCC(O)C(F)F
InChIInChI=1S/C10H11F2N3O2S/c11-9(12)7(16)4-13-8(17)3-6-5-15-1-2-18-10(15)14-6/h1-2,5,7,9,16H,3-4H2,(H,13,17)
InChIKeyNPZHYQAWBPWFGA-UHFFFAOYSA-N
XLogP0.68
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The IUPAC name of N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (CID 103770471) is N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.
What is the SMILES notation for N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The canonical SMILES for N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is O=C(Cc1cn2ccsc2n1)NCC(O)C(F)F.
What is the InChIKey of N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The InChIKey is NPZHYQAWBPWFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2N3O2S/c11-9(12)7(16)4-13-8(17)3-6-5-15-1-2-18-10(15)14-6/h1-2,5,7,9,16H,3-4H2,(H,13,17).
What are the key properties of N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide has a molecular weight of 275.28 g/mol, XLogP of 0.68, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-difluoro-2-hydroxypropyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is sourced from PubChem (CID 103770471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).