2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one

C11H7N3OS — CID 11746413

IUPAC2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one
SMILESO=c1c2cccnc2sn1-c1ccncc1
InChIInChI=1S/C11H7N3OS/c15-11-9-2-1-5-13-10(9)16-14(11)8-3-6-12-7-4-8/h1-7H
InChIKeySVFHINLBNWYTPS-UHFFFAOYSA-N
MW229.26 g/mol
LogP1.84
Rot. Bonds1

About 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one

2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one (PubChem CID 11746413) has the molecular formula C11H7N3OS and a molecular weight of 229.26 g/mol. Its IUPAC name is 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one.

Molecular Properties

Compound Name2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one
PubChem CID11746413
Molecular FormulaC11H7N3OS
Molecular Weight229.26 g/mol
Exact Mass229.03
IUPAC Name2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one
SMILESO=c1c2cccnc2sn1-c1ccncc1
InChIInChI=1S/C11H7N3OS/c15-11-9-2-1-5-13-10(9)16-14(11)8-3-6-12-7-4-8/h1-7H
InChIKeySVFHINLBNWYTPS-UHFFFAOYSA-N
XLogP1.84
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-Pyridylnicotinamide
CID 3049109
2H,3H-[1,2]thiazolo[5,4-b]pyridin-3-one
CID 2727563
Xg076
CID 5703
2-(4-Fluorophenyl)isothiazolo[5,4-b]pyridin-3(2H)-one
CID 9992116
2-(4-(Trifluoromethyl)benzyl)isothiazolo[5,4-b]pyridin-3(2H)-one
CID 53257845
1,2-Dithiolo(3,4-b)pyridin-3-one
CID 342690
2-Isobutyl-isothiazolo[5,4-b]pyridin-3-one
CID 11127503
2-(methylsulfanyl)-N-(pyridin-4-yl)pyridine-3-carboxamide
CID 18109232
2-(4-Butylphenyl)isothiazolo[5,4-b]pyridin-3(2H)-one
CID 393169
2-Benzyl-[1,2]thiazolo[5,4-b]pyridin-3-one
CID 5271649
2-(2,6-Dimethylphenyl)-[1,2]thiazolo[5,4-b]pyridin-3-one
CID 10332643
2-(4-Chlorophenyl)-[1,2]thiazolo[5,4-b]pyridin-3-one
CID 10355367

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one?
The IUPAC name of 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one (CID 11746413) is 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one.
What is the SMILES notation for 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one?
The canonical SMILES for 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one is O=c1c2cccnc2sn1-c1ccncc1.
What is the InChIKey of 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one?
The InChIKey is SVFHINLBNWYTPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3OS/c15-11-9-2-1-5-13-10(9)16-14(11)8-3-6-12-7-4-8/h1-7H.
What are the key properties of 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one?
2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one has a molecular weight of 229.26 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-4-yl-[1,2]thiazolo[5,4-b]pyridin-3-one is sourced from PubChem (CID 11746413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).