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

C22H20N4O — CID 171471565

IUPAC6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine
SMILESc1cc(-c2coc3cc(-c4ccc(N5CCCCC5)nc4)cnc23)ccn1
InChIInChI=1S/C22H20N4O/c1-2-10-26(11-3-1)21-5-4-17(13-24-21)18-12-20-22(25-14-18)19(15-27-20)16-6-8-23-9-7-16/h4-9,12-15H,1-3,10-11H2
InChIKeyQDAWDOGEVCHNKR-UHFFFAOYSA-N
MW356.43 g/mol
LogP4.94
Rot. Bonds3

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

6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine (PubChem CID 171471565) has the molecular formula C22H20N4O and a molecular weight of 356.43 g/mol. Its IUPAC name is 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine.

Molecular Properties

Compound Name6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine
PubChem CID171471565
Molecular FormulaC22H20N4O
Molecular Weight356.43 g/mol
Exact Mass356.16
IUPAC Name6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine
SMILESc1cc(-c2coc3cc(-c4ccc(N5CCCCC5)nc4)cnc23)ccn1
InChIInChI=1S/C22H20N4O/c1-2-10-26(11-3-1)21-5-4-17(13-24-21)18-12-20-22(25-14-18)19(15-27-20)16-6-8-23-9-7-16/h4-9,12-15H,1-3,10-11H2
InChIKeyQDAWDOGEVCHNKR-UHFFFAOYSA-N
XLogP4.94
TPSA55.05 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine?
The IUPAC name of 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine (CID 171471565) is 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine.
What is the SMILES notation for 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine?
The canonical SMILES for 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine is c1cc(-c2coc3cc(-c4ccc(N5CCCCC5)nc4)cnc23)ccn1.
What is the InChIKey of 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine?
The InChIKey is QDAWDOGEVCHNKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O/c1-2-10-26(11-3-1)21-5-4-17(13-24-21)18-12-20-22(25-14-18)19(15-27-20)16-6-8-23-9-7-16/h4-9,12-15H,1-3,10-11H2.
What are the key properties of 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine?
6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine has a molecular weight of 356.43 g/mol, XLogP of 4.94, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-piperidin-1-yl-3-pyridinyl)-3-pyridin-4-ylfuro[3,2-b]pyridine is sourced from PubChem (CID 171471565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).