6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine

C20H22FN3S — CID 166882821

IUPAC6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine
SMILESFCCCC1CCN(c2ccc3cc(-c4cccnc4)sc3n2)CC1
InChIInChI=1S/C20H22FN3S/c21-9-1-3-15-7-11-24(12-8-15)19-6-5-16-13-18(25-20(16)23-19)17-4-2-10-22-14-17/h2,4-6,10,13-15H,1,3,7-9,11-12H2
InChIKeySNWULEYQZCPYGZ-UHFFFAOYSA-N
MW355.48 g/mol
LogP5.32
Rot. Bonds5

About 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine

6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine (PubChem CID 166882821) has the molecular formula C20H22FN3S and a molecular weight of 355.48 g/mol. Its IUPAC name is 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine.

Molecular Properties

Compound Name6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine
PubChem CID166882821
Molecular FormulaC20H22FN3S
Molecular Weight355.48 g/mol
Exact Mass355.15
IUPAC Name6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine
SMILESFCCCC1CCN(c2ccc3cc(-c4cccnc4)sc3n2)CC1
InChIInChI=1S/C20H22FN3S/c21-9-1-3-15-7-11-24(12-8-15)19-6-5-16-13-18(25-20(16)23-19)17-4-2-10-22-14-17/h2,4-6,10,13-15H,1,3,7-9,11-12H2
InChIKeySNWULEYQZCPYGZ-UHFFFAOYSA-N
XLogP5.32
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.48
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine?
The IUPAC name of 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine (CID 166882821) is 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine.
What is the SMILES notation for 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine?
The canonical SMILES for 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine is FCCCC1CCN(c2ccc3cc(-c4cccnc4)sc3n2)CC1.
What is the InChIKey of 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine?
The InChIKey is SNWULEYQZCPYGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3S/c21-9-1-3-15-7-11-24(12-8-15)19-6-5-16-13-18(25-20(16)23-19)17-4-2-10-22-14-17/h2,4-6,10,13-15H,1,3,7-9,11-12H2.
What are the key properties of 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine?
6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine has a molecular weight of 355.48 g/mol, XLogP of 5.32, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(3-fluoropropyl)piperidin-1-yl]-2-pyridin-3-ylthieno[2,3-b]pyridine is sourced from PubChem (CID 166882821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).