2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one

C13H9FN2OS — CID 177336162

IUPAC2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one
SMILESCc1ccc(-n2ccc3cc(F)sc3c2=O)cn1
InChIInChI=1S/C13H9FN2OS/c1-8-2-3-10(7-15-8)16-5-4-9-6-11(14)18-12(9)13(16)17/h2-7H,1H3
InChIKeyWMQRQJAOLTXQSY-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.89
Rot. Bonds1

About 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one

2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one (PubChem CID 177336162) has the molecular formula C13H9FN2OS and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one.

Molecular Properties

Compound Name2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one
PubChem CID177336162
Molecular FormulaC13H9FN2OS
Molecular Weight260.29 g/mol
Exact Mass260.04
IUPAC Name2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one
SMILESCc1ccc(-n2ccc3cc(F)sc3c2=O)cn1
InChIInChI=1S/C13H9FN2OS/c1-8-2-3-10(7-15-8)16-5-4-9-6-11(14)18-12(9)13(16)17/h2-7H,1H3
InChIKeyWMQRQJAOLTXQSY-UHFFFAOYSA-N
XLogP2.89
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one?
The IUPAC name of 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one (CID 177336162) is 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one.
What is the SMILES notation for 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one?
The canonical SMILES for 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one is Cc1ccc(-n2ccc3cc(F)sc3c2=O)cn1.
What is the InChIKey of 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one?
The InChIKey is WMQRQJAOLTXQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2OS/c1-8-2-3-10(7-15-8)16-5-4-9-6-11(14)18-12(9)13(16)17/h2-7H,1H3.
What are the key properties of 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one?
2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one has a molecular weight of 260.29 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-(6-methyl-3-pyridinyl)thieno[2,3-c]pyridin-7-one is sourced from PubChem (CID 177336162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).