N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide

C15H12N2O3 — CID 1503572

IUPACN-(6-methoxy-3-pyridinyl)-1-benzofuran-2-carboxamide
SMILESCOC1=NC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3O2
InChIInChI=1S/C15H12N2O3/c1-19-14-7-6-11(9-16-14)17-15(18)13-8-10-4-2-3-5-12(10)20-13/h2-9H,1H3,(H,17,18)
InChIKeyVIWLKZMUDIMDKO-UHFFFAOYSA-N
MW268.27 g/mol
LogP2.70
Rot. Bonds3

About N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide

N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide (PubChem CID 1503572) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide
PubChem CID1503572
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC NameN-(6-methoxy-3-pyridinyl)-1-benzofuran-2-carboxamide
SMILESCOC1=NC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3O2
InChIInChI=1S/C15H12N2O3/c1-19-14-7-6-11(9-16-14)17-15(18)13-8-10-4-2-3-5-12(10)20-13/h2-9H,1H3,(H,17,18)
InChIKeyVIWLKZMUDIMDKO-UHFFFAOYSA-N
XLogP2.70
TPSA64.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity350

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide (CID 1503572) is N-(6-methoxy-3-pyridinyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide is COC1=NC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3O2.
What is the InChIKey of N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide?
The InChIKey is VIWLKZMUDIMDKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c1-19-14-7-6-11(9-16-14)17-15(18)13-8-10-4-2-3-5-12(10)20-13/h2-9H,1H3,(H,17,18).
What are the key properties of N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide?
N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide has a molecular weight of 268.27 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 1503572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).