7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide

C20H20N2O4 — CID 46216787

IUPAC7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide
SMILESCOc1ccc(-c2ccccc2)c2cc(C(=O)NN3CCOCC3)oc12
InChIInChI=1S/C20H20N2O4/c1-24-17-8-7-15(14-5-3-2-4-6-14)16-13-18(26-19(16)17)20(23)21-22-9-11-25-12-10-22/h2-8,13H,9-12H2,1H3,(H,21,23)
InChIKeyWEACVDOVABHFDR-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.09
Rot. Bonds4

About 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide

7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide (PubChem CID 46216787) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide
PubChem CID46216787
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC Name7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide
SMILESCOc1ccc(-c2ccccc2)c2cc(C(=O)NN3CCOCC3)oc12
InChIInChI=1S/C20H20N2O4/c1-24-17-8-7-15(14-5-3-2-4-6-14)16-13-18(26-19(16)17)20(23)21-22-9-11-25-12-10-22/h2-8,13H,9-12H2,1H3,(H,21,23)
InChIKeyWEACVDOVABHFDR-UHFFFAOYSA-N
XLogP3.09
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide?
The IUPAC name of 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide (CID 46216787) is 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide?
The canonical SMILES for 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide is COc1ccc(-c2ccccc2)c2cc(C(=O)NN3CCOCC3)oc12.
What is the InChIKey of 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide?
The InChIKey is WEACVDOVABHFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-24-17-8-7-15(14-5-3-2-4-6-14)16-13-18(26-19(16)17)20(23)21-22-9-11-25-12-10-22/h2-8,13H,9-12H2,1H3,(H,21,23).
What are the key properties of 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide?
7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-morpholin-4-yl-4-phenyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 46216787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).