5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide

C22H21NO5 — CID 35529765

IUPAC5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(COc2ccc(C(C)=O)cc2)o1
InChIInChI=1S/C22H21NO5/c1-3-26-20-7-5-4-6-19(20)23-22(25)21-13-12-18(28-21)14-27-17-10-8-16(9-11-17)15(2)24/h4-13H,3,14H2,1-2H3,(H,23,25)
InChIKeyPRGQNMRYKMSRBI-UHFFFAOYSA-N
MW379.41 g/mol
LogP4.71
Rot. Bonds8

About 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide

5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide (PubChem CID 35529765) has the molecular formula C22H21NO5 and a molecular weight of 379.41 g/mol. Its IUPAC name is 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide
PubChem CID35529765
Molecular FormulaC22H21NO5
Molecular Weight379.41 g/mol
Exact Mass379.14
IUPAC Name5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(COc2ccc(C(C)=O)cc2)o1
InChIInChI=1S/C22H21NO5/c1-3-26-20-7-5-4-6-19(20)23-22(25)21-13-12-18(28-21)14-27-17-10-8-16(9-11-17)15(2)24/h4-13H,3,14H2,1-2H3,(H,23,25)
InChIKeyPRGQNMRYKMSRBI-UHFFFAOYSA-N
XLogP4.71
TPSA77.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.41
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 35529212
N-(4-acetamidophenyl)-5-[(4-acetylphenoxy)methyl]furan-2-carboxamide
CID 19455187
N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 26774462
5-[(4-acetylphenoxy)methyl]-N-[2-(difluoromethoxy)-4-methylphenyl]furan-2-carboxamide
CID 19455292
5-[(4-acetylphenoxy)methyl]-N-(2-fluoro-5-methylphenyl)furan-2-carboxamide
CID 19455249
5-[(4-acetylphenoxy)methyl]-N-pyridin-4-ylfuran-2-carboxamide
CID 19455200
N-(2-cyanophenyl)-5-[(4-propylphenoxy)methyl]furan-2-carboxamide
CID 19454573
5-(benzenesulfonylmethyl)-N-(2-ethoxyphenyl)furan-2-carboxamide
CID 26736329
N-(4-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 19467513
N-(2-chlorophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 7679417
5-[(2-ethoxyphenoxy)methyl]furan-2-carbohydrazide
CID 7018661
methyl 4-[[5-[[2-(trifluoromethyl)phenyl]carbamoyl]furan-2-yl]methoxy]benzoate
CID 19448946

Frequently Asked Questions

What is the IUPAC name of 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide?
The IUPAC name of 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide (CID 35529765) is 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide?
The canonical SMILES for 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide is CCOc1ccccc1NC(=O)c1ccc(COc2ccc(C(C)=O)cc2)o1.
What is the InChIKey of 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide?
The InChIKey is PRGQNMRYKMSRBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO5/c1-3-26-20-7-5-4-6-19(20)23-22(25)21-13-12-18(28-21)14-27-17-10-8-16(9-11-17)15(2)24/h4-13H,3,14H2,1-2H3,(H,23,25).
What are the key properties of 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide?
5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide has a molecular weight of 379.41 g/mol, XLogP of 4.71, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 35529765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).