2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine

C22H15N3OS — CID 155204919

IUPAC2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine
SMILESc1cnc2oc(-c3ccc4cc(-c5ccc6c(n5)CCC6)sc4n3)cc2c1
InChIInChI=1S/C22H15N3OS/c1-3-13-6-9-18(24-16(13)5-1)20-12-15-7-8-17(25-22(15)27-20)19-11-14-4-2-10-23-21(14)26-19/h2,4,6-12H,1,3,5H2
InChIKeyGDLWBBWAISVBTE-UHFFFAOYSA-N
MW369.45 g/mol
LogP5.66
Rot. Bonds2

About 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine

2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine (PubChem CID 155204919) has the molecular formula C22H15N3OS and a molecular weight of 369.45 g/mol. Its IUPAC name is 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine.

Molecular Properties

Compound Name2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine
PubChem CID155204919
Molecular FormulaC22H15N3OS
Molecular Weight369.45 g/mol
Exact Mass369.09
IUPAC Name2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine
SMILESc1cnc2oc(-c3ccc4cc(-c5ccc6c(n5)CCC6)sc4n3)cc2c1
InChIInChI=1S/C22H15N3OS/c1-3-13-6-9-18(24-16(13)5-1)20-12-15-7-8-17(25-22(15)27-20)19-11-14-4-2-10-23-21(14)26-19/h2,4,6-12H,1,3,5H2
InChIKeyGDLWBBWAISVBTE-UHFFFAOYSA-N
XLogP5.66
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.45
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine?
The IUPAC name of 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine (CID 155204919) is 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine.
What is the SMILES notation for 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine?
The canonical SMILES for 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine is c1cnc2oc(-c3ccc4cc(-c5ccc6c(n5)CCC6)sc4n3)cc2c1.
What is the InChIKey of 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine?
The InChIKey is GDLWBBWAISVBTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N3OS/c1-3-13-6-9-18(24-16(13)5-1)20-12-15-7-8-17(25-22(15)27-20)19-11-14-4-2-10-23-21(14)26-19/h2,4,6-12H,1,3,5H2.
What are the key properties of 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine?
2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine has a molecular weight of 369.45 g/mol, XLogP of 5.66, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thieno[2,3-b]pyridin-6-yl]furo[2,3-b]pyridine is sourced from PubChem (CID 155204919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).