6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine

C17H12N2O — CID 90140756

IUPAC6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine
SMILESCc1ccnc(-c2cccc3c2oc2ccncc23)c1
InChIInChI=1S/C17H12N2O/c1-11-5-8-19-15(9-11)13-4-2-3-12-14-10-18-7-6-16(14)20-17(12)13/h2-10H,1H3
InChIKeyIWNQAYATAJWFKT-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.35
Rot. Bonds1

About 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine

6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine (PubChem CID 90140756) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine.

Molecular Properties

Compound Name6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine
PubChem CID90140756
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine
SMILESCc1ccnc(-c2cccc3c2oc2ccncc23)c1
InChIInChI=1S/C17H12N2O/c1-11-5-8-19-15(9-11)13-4-2-3-12-14-10-18-7-6-16(14)20-17(12)13/h2-10H,1H3
InChIKeyIWNQAYATAJWFKT-UHFFFAOYSA-N
XLogP4.35
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine?
The IUPAC name of 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine (CID 90140756) is 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine.
What is the SMILES notation for 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine?
The canonical SMILES for 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine is Cc1ccnc(-c2cccc3c2oc2ccncc23)c1.
What is the InChIKey of 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine?
The InChIKey is IWNQAYATAJWFKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-11-5-8-19-15(9-11)13-4-2-3-12-14-10-18-7-6-16(14)20-17(12)13/h2-10H,1H3.
What are the key properties of 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine?
6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine has a molecular weight of 260.30 g/mol, XLogP of 4.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methyl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine is sourced from PubChem (CID 90140756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).