N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide

C20H21NO4 — CID 60607084

IUPACN-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide
SMILESCCOc1cccc2cc(C(C)NC(=O)c3ccc(OC)cc3)oc12
InChIInChI=1S/C20H21NO4/c1-4-24-17-7-5-6-15-12-18(25-19(15)17)13(2)21-20(22)14-8-10-16(23-3)11-9-14/h5-13H,4H2,1-3H3,(H,21,22)
InChIKeyWWLHISVURHLGOJ-UHFFFAOYSA-N
MW339.39 g/mol
LogP4.33
Rot. Bonds6

About N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide

N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide (PubChem CID 60607084) has the molecular formula C20H21NO4 and a molecular weight of 339.39 g/mol. Its IUPAC name is N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide
PubChem CID60607084
Molecular FormulaC20H21NO4
Molecular Weight339.39 g/mol
Exact Mass339.15
IUPAC NameN-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide
SMILESCCOc1cccc2cc(C(C)NC(=O)c3ccc(OC)cc3)oc12
InChIInChI=1S/C20H21NO4/c1-4-24-17-7-5-6-15-12-18(25-19(15)17)13(2)21-20(22)14-8-10-16(23-3)11-9-14/h5-13H,4H2,1-3H3,(H,21,22)
InChIKeyWWLHISVURHLGOJ-UHFFFAOYSA-N
XLogP4.33
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.39
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1R)-1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-2H-benzotriazole-5-carboxamide
CID 39968255
N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-(4-ethoxyphenyl)-4-oxobutanamide
CID 55396325
1-[(1S)-1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-3-(2-methoxyphenyl)urea
CID 39972995
N-[(1S)-1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-1H-1,2,4-triazole-5-carboxamide
CID 97237661
4-amino-N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]pentanamide
CID 120559371
N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-2-fluoroprop-2-enamide
CID 166417291
2-bromo-N-[(1S)-1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-5-fluorobenzamide
CID 25468831
N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
CID 55397690
1-amino-N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]cyclohexane-1-carboxamide
CID 119273327
N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 18282452
1-[1-(7-ethoxy-1-benzofuran-2-yl)ethylamino]ethanol
CID 175788600
ethyl 6-[1-(7-ethoxy-1-benzofuran-2-yl)ethylcarbamoyl]-2-methylpyridine-3-carboxylate
CID 55633376

Frequently Asked Questions

What is the IUPAC name of N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide?
The IUPAC name of N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide (CID 60607084) is N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide.
What is the SMILES notation for N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide?
The canonical SMILES for N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide is CCOc1cccc2cc(C(C)NC(=O)c3ccc(OC)cc3)oc12.
What is the InChIKey of N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide?
The InChIKey is WWLHISVURHLGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO4/c1-4-24-17-7-5-6-15-12-18(25-19(15)17)13(2)21-20(22)14-8-10-16(23-3)11-9-14/h5-13H,4H2,1-3H3,(H,21,22).
What are the key properties of N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide?
N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide has a molecular weight of 339.39 g/mol, XLogP of 4.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(7-ethoxy-1-benzofuran-2-yl)ethyl]-4-methoxybenzamide is sourced from PubChem (CID 60607084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).