5-methoxy-2-phenyl-1-benzofuran-3-carboxamide

C16H13NO3 — CID 779313

IUPAC5-methoxy-2-phenyl-1-benzofuran-3-carboxamide
SMILESCOc1ccc2oc(-c3ccccc3)c(C(N)=O)c2c1
InChIInChI=1S/C16H13NO3/c1-19-11-7-8-13-12(9-11)14(16(17)18)15(20-13)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18)
InChIKeyFUMUQFGFJALFJP-UHFFFAOYSA-N
MW267.28 g/mol
LogP3.21
Rot. Bonds3

About 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide

5-methoxy-2-phenyl-1-benzofuran-3-carboxamide (PubChem CID 779313) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide.

Molecular Properties

Compound Name5-methoxy-2-phenyl-1-benzofuran-3-carboxamide
PubChem CID779313
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC Name5-methoxy-2-phenyl-1-benzofuran-3-carboxamide
SMILESCOc1ccc2oc(-c3ccccc3)c(C(N)=O)c2c1
InChIInChI=1S/C16H13NO3/c1-19-11-7-8-13-12(9-11)14(16(17)18)15(20-13)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18)
InChIKeyFUMUQFGFJALFJP-UHFFFAOYSA-N
XLogP3.21
TPSA65.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide?
The IUPAC name of 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide (CID 779313) is 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide.
What is the SMILES notation for 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide?
The canonical SMILES for 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide is COc1ccc2oc(-c3ccccc3)c(C(N)=O)c2c1.
What is the InChIKey of 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide?
The InChIKey is FUMUQFGFJALFJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c1-19-11-7-8-13-12(9-11)14(16(17)18)15(20-13)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18).
What are the key properties of 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide?
5-methoxy-2-phenyl-1-benzofuran-3-carboxamide has a molecular weight of 267.28 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-phenyl-1-benzofuran-3-carboxamide is sourced from PubChem (CID 779313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).