N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide

C18H17NO4 — CID 126194395

IUPACN-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide
SMILESCCOc1cccc(NC(=O)c2cc3cc(OC)ccc3o2)c1
InChIInChI=1S/C18H17NO4/c1-3-22-15-6-4-5-13(11-15)19-18(20)17-10-12-9-14(21-2)7-8-16(12)23-17/h4-11H,3H2,1-2H3,(H,19,20)
InChIKeyWYNBTGSYLPIWJJ-UHFFFAOYSA-N
MW311.34 g/mol
LogP4.09
Rot. Bonds5

About N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide

N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide (PubChem CID 126194395) has the molecular formula C18H17NO4 and a molecular weight of 311.34 g/mol. Its IUPAC name is N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide
PubChem CID126194395
Molecular FormulaC18H17NO4
Molecular Weight311.34 g/mol
Exact Mass311.12
IUPAC NameN-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide
SMILESCCOc1cccc(NC(=O)c2cc3cc(OC)ccc3o2)c1
InChIInChI=1S/C18H17NO4/c1-3-22-15-6-4-5-13(11-15)19-18(20)17-10-12-9-14(21-2)7-8-16(12)23-17/h4-11H,3H2,1-2H3,(H,19,20)
InChIKeyWYNBTGSYLPIWJJ-UHFFFAOYSA-N
XLogP4.09
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-bromophenyl)-5-methoxy-1-benzofuran-2-carboxamide
CID 51432230
5-methoxy-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
CID 51432206
3-[(3-ethoxyphenyl)methoxy]-2-[(5-methoxy-1-benzofuran-2-carbonyl)amino]propanoic acid
CID 70651372
3-amino-5-ethoxy-N-(3-methoxyphenyl)benzamide
CID 81094945
5-bromo-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
CID 2986420
2-(3-ethoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 112977809
2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide
CID 81394304
2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
N-(3-ethoxyphenyl)-2-hydrazinylbenzamide
CID 62247314
2-(aminomethyl)-N-(3-ethoxyphenyl)-1,3-thiazole-4-carboxamide
CID 66378221
5-bromo-N-[3-(difluoromethoxy)phenyl]-1-benzofuran-2-carboxamide
CID 55782296
5-methyl-N-(3-propoxyphenyl)furan-2-carboxamide
CID 2260679

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide?
The IUPAC name of N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide (CID 126194395) is N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide is CCOc1cccc(NC(=O)c2cc3cc(OC)ccc3o2)c1.
What is the InChIKey of N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide?
The InChIKey is WYNBTGSYLPIWJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO4/c1-3-22-15-6-4-5-13(11-15)19-18(20)17-10-12-9-14(21-2)7-8-16(12)23-17/h4-11H,3H2,1-2H3,(H,19,20).
What are the key properties of N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide?
N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide has a molecular weight of 311.34 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyphenyl)-5-methoxy-1-benzofuran-2-carboxamide is sourced from PubChem (CID 126194395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).