2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one

C12H7NO2S — CID 14343362

IUPAC2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one
SMILESO=c1cc(-c2ccco2)sc2ncccc12
InChIInChI=1S/C12H7NO2S/c14-9-7-11(10-4-2-6-15-10)16-12-8(9)3-1-5-13-12/h1-7H
InChIKeyBUEWRJWXUMVNAQ-UHFFFAOYSA-N
MW229.26 g/mol
LogP2.92
Rot. Bonds1

About 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one

2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one (PubChem CID 14343362) has the molecular formula C12H7NO2S and a molecular weight of 229.26 g/mol. Its IUPAC name is 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one.

Molecular Properties

Compound Name2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one
PubChem CID14343362
Molecular FormulaC12H7NO2S
Molecular Weight229.26 g/mol
Exact Mass229.02
IUPAC Name2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one
SMILESO=c1cc(-c2ccco2)sc2ncccc12
InChIInChI=1S/C12H7NO2S/c14-9-7-11(10-4-2-6-15-10)16-12-8(9)3-1-5-13-12/h1-7H
InChIKeyBUEWRJWXUMVNAQ-UHFFFAOYSA-N
XLogP2.92
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

S-(5-(Pyridin-3-yl)furan-2-yl)methyl ethanethioate
CID 11993872
3-(Furan-2-yl)pyridine
CID 11137298
3-(Furan-2-yl)-1-(pyridin-3-yl)prop-2-en-1-one
CID 5915551
2-[(2-furylmethyl)amino]-4H-pyrido[3,2-e][1,3]thiazin-4-one
CID 2217458
(E)-3-Furan-3-yl-1-pyridin-3-yl-propenone
CID 11571968
5-(2-Pyridinylsulfanyl)-2-furaldehyde
CID 2794784
N-(furan-3-ylmethyl)-2-propan-2-ylsulfanylpyridine-3-carboxamide
CID 45834348
N-(furan-3-ylmethyl)-N-(2-methoxyethyl)-2-(methylthio)nicotinamide
CID 71803955
(E)-1-(6-ethoxy-3-pyridinyl)-3-thiophen-2-ylprop-2-en-1-one
CID 156019154
2-(((Furan-2-yl)methyl)sulfanyl)pyridine-3-carboxylic acid
CID 17605191
1-(Furan-2-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone
CID 2413702
3-(4-Fluorophenyl)-3-(furan-2-ylmethylsulfanyl)-1-pyridin-4-ylpropan-1-one
CID 5244886

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one?
The IUPAC name of 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one (CID 14343362) is 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one.
What is the SMILES notation for 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one?
The canonical SMILES for 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one is O=c1cc(-c2ccco2)sc2ncccc12.
What is the InChIKey of 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one?
The InChIKey is BUEWRJWXUMVNAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7NO2S/c14-9-7-11(10-4-2-6-15-10)16-12-8(9)3-1-5-13-12/h1-7H.
What are the key properties of 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one?
2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one has a molecular weight of 229.26 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)thiopyrano[2,3-b]pyridin-4-one is sourced from PubChem (CID 14343362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).