2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide

C20H14FN3O2S — CID 121024372

IUPAC2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide
SMILESO=C(COc1ccccc1F)Nc1ccc(-c2nc3cccnc3s2)cc1
InChIInChI=1S/C20H14FN3O2S/c21-15-4-1-2-6-17(15)26-12-18(25)23-14-9-7-13(8-10-14)19-24-16-5-3-11-22-20(16)27-19/h1-11H,12H2,(H,23,25)
InChIKeyZGGYQYYKJGBDPF-UHFFFAOYSA-N
MW379.42 g/mol
LogP4.51
Rot. Bonds5

About 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide

2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide (PubChem CID 121024372) has the molecular formula C20H14FN3O2S and a molecular weight of 379.42 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide
PubChem CID121024372
Molecular FormulaC20H14FN3O2S
Molecular Weight379.42 g/mol
Exact Mass379.08
IUPAC Name2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide
SMILESO=C(COc1ccccc1F)Nc1ccc(-c2nc3cccnc3s2)cc1
InChIInChI=1S/C20H14FN3O2S/c21-15-4-1-2-6-17(15)26-12-18(25)23-14-9-7-13(8-10-14)19-24-16-5-3-11-22-20(16)27-19/h1-11H,12H2,(H,23,25)
InChIKeyZGGYQYYKJGBDPF-UHFFFAOYSA-N
XLogP4.51
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide (CID 121024372) is 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide is O=C(COc1ccccc1F)Nc1ccc(-c2nc3cccnc3s2)cc1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide?
The InChIKey is ZGGYQYYKJGBDPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O2S/c21-15-4-1-2-6-17(15)26-12-18(25)23-14-9-7-13(8-10-14)19-24-16-5-3-11-22-20(16)27-19/h1-11H,12H2,(H,23,25).
What are the key properties of 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide?
2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide has a molecular weight of 379.42 g/mol, XLogP of 4.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]acetamide is sourced from PubChem (CID 121024372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).