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

C19H17FN4S — CID 44579350

IUPAC1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1cn2c(-c3ccncc3)c(-c3ccc(F)cc3)nc2s1
InChIInChI=1S/C19H17FN4S/c1-23(2)11-16-12-24-18(14-7-9-21-10-8-14)17(22-19(24)25-16)13-3-5-15(20)6-4-13/h3-10,12H,11H2,1-2H3
InChIKeyZMLAYUNPFXQQKE-UHFFFAOYSA-N
MW352.44 g/mol
LogP4.33
Rot. Bonds4

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

1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine (PubChem CID 44579350) has the molecular formula C19H17FN4S and a molecular weight of 352.44 g/mol. Its IUPAC name is 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine
PubChem CID44579350
Molecular FormulaC19H17FN4S
Molecular Weight352.44 g/mol
Exact Mass352.12
IUPAC Name1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1cn2c(-c3ccncc3)c(-c3ccc(F)cc3)nc2s1
InChIInChI=1S/C19H17FN4S/c1-23(2)11-16-12-24-18(14-7-9-21-10-8-14)17(22-19(24)25-16)13-3-5-15(20)6-4-13/h3-10,12H,11H2,1-2H3
InChIKeyZMLAYUNPFXQQKE-UHFFFAOYSA-N
XLogP4.33
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine (CID 44579350) is 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine is CN(C)Cc1cn2c(-c3ccncc3)c(-c3ccc(F)cc3)nc2s1.
What is the InChIKey of 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine?
The InChIKey is ZMLAYUNPFXQQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN4S/c1-23(2)11-16-12-24-18(14-7-9-21-10-8-14)17(22-19(24)25-16)13-3-5-15(20)6-4-13/h3-10,12H,11H2,1-2H3.
What are the key properties of 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine?
1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine has a molecular weight of 352.44 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4-fluorophenyl)-5-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-2-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 44579350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).