2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide

C24H22N2O5 — CID 4805328

IUPAC2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
SMILESCOc1cc2c(cc1NC(=O)C(C)Oc1ccc(NC(C)=O)cc1)oc1ccccc12
InChIInChI=1S/C24H22N2O5/c1-14(30-17-10-8-16(9-11-17)25-15(2)27)24(28)26-20-13-22-19(12-23(20)29-3)18-6-4-5-7-21(18)31-22/h4-14H,1-3H3,(H,25,27)(H,26,28)
InChIKeyBYARRGMSMPVBDN-UHFFFAOYSA-N
MW418.45 g/mol
LogP4.96
Rot. Bonds6

About 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide

2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide (PubChem CID 4805328) has the molecular formula C24H22N2O5 and a molecular weight of 418.45 g/mol. Its IUPAC name is 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide.

Molecular Properties

Compound Name2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
PubChem CID4805328
Molecular FormulaC24H22N2O5
Molecular Weight418.45 g/mol
Exact Mass418.15
IUPAC Name2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
SMILESCOc1cc2c(cc1NC(=O)C(C)Oc1ccc(NC(C)=O)cc1)oc1ccccc12
InChIInChI=1S/C24H22N2O5/c1-14(30-17-10-8-16(9-11-17)25-15(2)27)24(28)26-20-13-22-19(12-23(20)29-3)18-6-4-5-7-21(18)31-22/h4-14H,1-3H3,(H,25,27)(H,26,28)
InChIKeyBYARRGMSMPVBDN-UHFFFAOYSA-N
XLogP4.96
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 54.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-(4-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7962389
2-(3-ethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 22831051
(2S)-2-(2-fluorophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7815222
N-(2-methoxydibenzofuran-3-yl)-2-[4-(tetrazol-1-yl)phenoxy]propanamide
CID 47004283
2-(2,3-dimethylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 18291295
(2S)-2-(4-chloro-2-methylphenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide
CID 7916291
[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] 2-methoxybenzoate
CID 7811454
(2S)-N-(2-methoxydibenzofuran-3-yl)-2-(4-methylquinolin-2-yl)oxypropanamide
CID 25411874
(2S)-N-(4-acetylphenyl)-2-dibenzofuran-2-yloxypropanamide
CID 30545915
N-(2-methoxydibenzofuran-3-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119674201
N-dibenzofuran-3-yl-2-phenoxypropanamide
CID 133234579
[(2S)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl] (2S)-2-hydroxy-2-phenylacetate
CID 7821695

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The IUPAC name of 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide (CID 4805328) is 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide.
What is the SMILES notation for 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The canonical SMILES for 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide is COc1cc2c(cc1NC(=O)C(C)Oc1ccc(NC(C)=O)cc1)oc1ccccc12.
What is the InChIKey of 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
The InChIKey is BYARRGMSMPVBDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O5/c1-14(30-17-10-8-16(9-11-17)25-15(2)27)24(28)26-20-13-22-19(12-23(20)29-3)18-6-4-5-7-21(18)31-22/h4-14H,1-3H3,(H,25,27)(H,26,28).
What are the key properties of 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide?
2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide has a molecular weight of 418.45 g/mol, XLogP of 4.96, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenoxy)-N-(2-methoxydibenzofuran-3-yl)propanamide is sourced from PubChem (CID 4805328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).