6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide

C15H12N2O3 — CID 46881599

IUPAC6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide
SMILESCOc1ccc2cc(-c3ccc(C(N)=O)cn3)oc2c1
InChIInChI=1S/C15H12N2O3/c1-19-11-4-2-9-6-14(20-13(9)7-11)12-5-3-10(8-17-12)15(16)18/h2-8H,1H3,(H2,16,18)
InChIKeyDTLXNCUZLRAQRW-UHFFFAOYSA-N
MW268.27 g/mol
LogP2.60
Rot. Bonds3

About 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide

6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide (PubChem CID 46881599) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide
PubChem CID46881599
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Name6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide
SMILESCOc1ccc2cc(-c3ccc(C(N)=O)cn3)oc2c1
InChIInChI=1S/C15H12N2O3/c1-19-11-4-2-9-6-14(20-13(9)7-11)12-5-3-10(8-17-12)15(16)18/h2-8H,1H3,(H2,16,18)
InChIKeyDTLXNCUZLRAQRW-UHFFFAOYSA-N
XLogP2.60
TPSA78.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide?
The IUPAC name of 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide (CID 46881599) is 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide is COc1ccc2cc(-c3ccc(C(N)=O)cn3)oc2c1.
What is the InChIKey of 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide?
The InChIKey is DTLXNCUZLRAQRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c1-19-11-4-2-9-6-14(20-13(9)7-11)12-5-3-10(8-17-12)15(16)18/h2-8H,1H3,(H2,16,18).
What are the key properties of 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide?
6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide has a molecular weight of 268.27 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-methoxy-1-benzofuran-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 46881599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).