2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine

C20H19FN4S — CID 44579352

IUPAC2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine
SMILESCN(C)CCc1cn2c(-c3ccncc3)c(-c3ccc(F)cc3)nc2s1
InChIInChI=1S/C20H19FN4S/c1-24(2)12-9-17-13-25-19(15-7-10-22-11-8-15)18(23-20(25)26-17)14-3-5-16(21)6-4-14/h3-8,10-11,13H,9,12H2,1-2H3
InChIKeyAWNKCESEXLYYNM-UHFFFAOYSA-N
MW366.47 g/mol
LogP4.37
Rot. Bonds5

About 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine

2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine (PubChem CID 44579352) has the molecular formula C20H19FN4S and a molecular weight of 366.47 g/mol. Its IUPAC name is 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine
PubChem CID44579352
Molecular FormulaC20H19FN4S
Molecular Weight366.47 g/mol
Exact Mass366.13
IUPAC Name2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine
SMILESCN(C)CCc1cn2c(-c3ccncc3)c(-c3ccc(F)cc3)nc2s1
InChIInChI=1S/C20H19FN4S/c1-24(2)12-9-17-13-25-19(15-7-10-22-11-8-15)18(23-20(25)26-17)14-3-5-16(21)6-4-14/h3-8,10-11,13H,9,12H2,1-2H3
InChIKeyAWNKCESEXLYYNM-UHFFFAOYSA-N
XLogP4.37
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine?
The IUPAC name of 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine (CID 44579352) is 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine?
The canonical SMILES for 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine is CN(C)CCc1cn2c(-c3ccncc3)c(-c3ccc(F)cc3)nc2s1.
What is the InChIKey of 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine?
The InChIKey is AWNKCESEXLYYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4S/c1-24(2)12-9-17-13-25-19(15-7-10-22-11-8-15)18(23-20(25)26-17)14-3-5-16(21)6-4-14/h3-8,10-11,13H,9,12H2,1-2H3.
What are the key properties of 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine?
2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine has a molecular weight of 366.47 g/mol, XLogP of 4.37, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 44579352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).