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

C19H17N3O — CID 73334786

IUPAC4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESc1ccc(COc2cc(-c3cccnc3)c3c(n2)CCC3)nc1
InChIInChI=1S/C19H17N3O/c1-2-10-21-15(6-1)13-23-19-11-17(14-5-4-9-20-12-14)16-7-3-8-18(16)22-19/h1-2,4-6,9-12H,3,7-8,13H2
InChIKeyFVHPUFGOTNLTQC-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.61
Rot. Bonds4

About 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine

4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine (PubChem CID 73334786) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine.

Molecular Properties

Compound Name4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine
PubChem CID73334786
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine
SMILESc1ccc(COc2cc(-c3cccnc3)c3c(n2)CCC3)nc1
InChIInChI=1S/C19H17N3O/c1-2-10-21-15(6-1)13-23-19-11-17(14-5-4-9-20-12-14)16-7-3-8-18(16)22-19/h1-2,4-6,9-12H,3,7-8,13H2
InChIKeyFVHPUFGOTNLTQC-UHFFFAOYSA-N
XLogP3.61
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[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 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The IUPAC name of 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine (CID 73334786) is 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine.
What is the SMILES notation for 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The canonical SMILES for 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine is c1ccc(COc2cc(-c3cccnc3)c3c(n2)CCC3)nc1.
What is the InChIKey of 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine?
The InChIKey is FVHPUFGOTNLTQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-2-10-21-15(6-1)13-23-19-11-17(14-5-4-9-20-12-14)16-7-3-8-18(16)22-19/h1-2,4-6,9-12H,3,7-8,13H2.
What are the key properties of 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine?
4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine has a molecular weight of 303.37 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-3-yl-2-(pyridin-2-ylmethoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine is sourced from PubChem (CID 73334786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).