2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine

C20H13NO3 — CID 53361435

IUPAC2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine
SMILESc1coc(-c2cc(-c3ccco3)c3c(n2)-c2ccccc2OC3)c1
InChIInChI=1S/C20H13NO3/c1-2-6-17-13(5-1)20-15(12-24-17)14(18-7-3-9-22-18)11-16(21-20)19-8-4-10-23-19/h1-11H,12H2
InChIKeyVWOFTAMNVDDOSM-UHFFFAOYSA-N
MW315.33 g/mol
LogP5.16
Rot. Bonds2

About 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine

2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine (PubChem CID 53361435) has the molecular formula C20H13NO3 and a molecular weight of 315.33 g/mol. Its IUPAC name is 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine.

Molecular Properties

Compound Name2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine
PubChem CID53361435
Molecular FormulaC20H13NO3
Molecular Weight315.33 g/mol
Exact Mass315.09
IUPAC Name2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine
SMILESc1coc(-c2cc(-c3ccco3)c3c(n2)-c2ccccc2OC3)c1
InChIInChI=1S/C20H13NO3/c1-2-6-17-13(5-1)20-15(12-24-17)14(18-7-3-9-22-18)11-16(21-20)19-8-4-10-23-19/h1-11H,12H2
InChIKeyVWOFTAMNVDDOSM-UHFFFAOYSA-N
XLogP5.16
TPSA48.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.33
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,4-bis(furan-2-yl)-5H-chromeno[4,3-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 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine?
The IUPAC name of 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine (CID 53361435) is 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine.
What is the SMILES notation for 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine?
The canonical SMILES for 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine is c1coc(-c2cc(-c3ccco3)c3c(n2)-c2ccccc2OC3)c1.
What is the InChIKey of 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine?
The InChIKey is VWOFTAMNVDDOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13NO3/c1-2-6-17-13(5-1)20-15(12-24-17)14(18-7-3-9-22-18)11-16(21-20)19-8-4-10-23-19/h1-11H,12H2.
What are the key properties of 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine?
2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine has a molecular weight of 315.33 g/mol, XLogP of 5.16, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(furan-2-yl)-5H-chromeno[4,3-b]pyridine is sourced from PubChem (CID 53361435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).