5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide

C13H15NO4 — CID 175692247

IUPAC5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide
SMILESCOCOc1ccc2oc(C(=O)N(C)C)cc2c1
InChIInChI=1S/C13H15NO4/c1-14(2)13(15)12-7-9-6-10(17-8-16-3)4-5-11(9)18-12/h4-7H,8H2,1-3H3
InChIKeyHTXFGRYTLJLQBT-UHFFFAOYSA-N
MW249.27 g/mol
LogP2.12
Rot. Bonds4

About 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide

5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide (PubChem CID 175692247) has the molecular formula C13H15NO4 and a molecular weight of 249.27 g/mol. Its IUPAC name is 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide
PubChem CID175692247
Molecular FormulaC13H15NO4
Molecular Weight249.27 g/mol
Exact Mass249.10
IUPAC Name5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide
SMILESCOCOc1ccc2oc(C(=O)N(C)C)cc2c1
InChIInChI=1S/C13H15NO4/c1-14(2)13(15)12-7-9-6-10(17-8-16-3)4-5-11(9)18-12/h4-7H,8H2,1-3H3
InChIKeyHTXFGRYTLJLQBT-UHFFFAOYSA-N
XLogP2.12
TPSA51.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

5-[(dimethylamino)methoxy]-1-benzofuran-2-carboxylic acid
CID 142789197
5-butoxy-1-benzofuran-2-carboxylic acid
CID 67998736
5-(2-oxopropoxy)-1-benzofuran-2-carboxylic acid
CID 169229514
N-(2-hydroxypropyl)-N,5-dimethyl-1-benzofuran-2-carboxamide
CID 62335366
N-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-methyl-1-benzofuran-2-carboxamide
CID 115772526
N,N-dimethyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 39001167
N,N-dimethylbenzo[e][1]benzofuran-2-carboxamide
CID 2990859
5-amino-N-(2-amino-2-oxoethyl)-N-methyl-1-benzofuran-2-carboxamide
CID 61092833
N,5-dimethyl-N-propyl-1-benzofuran-2-carboxamide
CID 177170487
5-methoxy-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
CID 51432206
2-methyl-1-[5-[3-(sulfanylamino)propoxy]-1-benzofuran-2-yl]propan-1-one
CID 167256709
N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide
CID 126194395

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide?
The IUPAC name of 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide (CID 175692247) is 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide?
The canonical SMILES for 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide is COCOc1ccc2oc(C(=O)N(C)C)cc2c1.
What is the InChIKey of 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide?
The InChIKey is HTXFGRYTLJLQBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO4/c1-14(2)13(15)12-7-9-6-10(17-8-16-3)4-5-11(9)18-12/h4-7H,8H2,1-3H3.
What are the key properties of 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide?
5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide has a molecular weight of 249.27 g/mol, XLogP of 2.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethoxy)-N,N-dimethyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 175692247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).