7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide

C18H17NO3 — CID 6473184

IUPAC7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide
SMILESCOc1cccc2cc(C(=O)NCCc3ccccc3)oc12
InChIInChI=1S/C18H17NO3/c1-21-15-9-5-8-14-12-16(22-17(14)15)18(20)19-11-10-13-6-3-2-4-7-13/h2-9,12H,10-11H2,1H3,(H,19,20)
InChIKeyTYFQJEZMBBZSDE-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.41
Rot. Bonds5

About 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide

7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide (PubChem CID 6473184) has the molecular formula C18H17NO3 and a molecular weight of 295.34 g/mol. Its IUPAC name is 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide
PubChem CID6473184
Molecular FormulaC18H17NO3
Molecular Weight295.34 g/mol
Exact Mass295.12
IUPAC Name7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide
SMILESCOc1cccc2cc(C(=O)NCCc3ccccc3)oc12
InChIInChI=1S/C18H17NO3/c1-21-15-9-5-8-14-12-16(22-17(14)15)18(20)19-11-10-13-6-3-2-4-7-13/h2-9,12H,10-11H2,1H3,(H,19,20)
InChIKeyTYFQJEZMBBZSDE-UHFFFAOYSA-N
XLogP3.41
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide?
The IUPAC name of 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide (CID 6473184) is 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide is COc1cccc2cc(C(=O)NCCc3ccccc3)oc12.
What is the InChIKey of 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide?
The InChIKey is TYFQJEZMBBZSDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO3/c1-21-15-9-5-8-14-12-16(22-17(14)15)18(20)19-11-10-13-6-3-2-4-7-13/h2-9,12H,10-11H2,1H3,(H,19,20).
What are the key properties of 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide?
7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide has a molecular weight of 295.34 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(2-phenylethyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 6473184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).