7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide

C16H20N2O4 — CID 6472686

IUPAC7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide
SMILESCOc1cccc2cc(C(=O)NCCN3CCOCC3)oc12
InChIInChI=1S/C16H20N2O4/c1-20-13-4-2-3-12-11-14(22-15(12)13)16(19)17-5-6-18-7-9-21-10-8-18/h2-4,11H,5-10H2,1H3,(H,17,19)
InChIKeyQFUJLWJRQKXRQJ-UHFFFAOYSA-N
MW304.35 g/mol
LogP1.50
Rot. Bonds5

About 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide

7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide (PubChem CID 6472686) has the molecular formula C16H20N2O4 and a molecular weight of 304.35 g/mol. Its IUPAC name is 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide
PubChem CID6472686
Molecular FormulaC16H20N2O4
Molecular Weight304.35 g/mol
Exact Mass304.14
IUPAC Name7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide
SMILESCOc1cccc2cc(C(=O)NCCN3CCOCC3)oc12
InChIInChI=1S/C16H20N2O4/c1-20-13-4-2-3-12-11-14(22-15(12)13)16(19)17-5-6-18-7-9-21-10-8-18/h2-4,11H,5-10H2,1H3,(H,17,19)
InChIKeyQFUJLWJRQKXRQJ-UHFFFAOYSA-N
XLogP1.50
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide?
The IUPAC name of 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide (CID 6472686) is 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide is COc1cccc2cc(C(=O)NCCN3CCOCC3)oc12.
What is the InChIKey of 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide?
The InChIKey is QFUJLWJRQKXRQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O4/c1-20-13-4-2-3-12-11-14(22-15(12)13)16(19)17-5-6-18-7-9-21-10-8-18/h2-4,11H,5-10H2,1H3,(H,17,19).
What are the key properties of 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide?
7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(2-morpholin-4-ylethyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 6472686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).