1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide

C26H24N2O5 — CID 3936641

IUPAC1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCCOc1ccccc1N1CC(C(=O)Nc2cc3oc4ccccc4c3cc2OC)CC1=O
InChIInChI=1S/C26H24N2O5/c1-3-32-22-11-7-5-9-20(22)28-15-16(12-25(28)29)26(30)27-19-14-23-18(13-24(19)31-2)17-8-4-6-10-21(17)33-23/h4-11,13-14,16H,3,12,15H2,1-2H3,(H,27,30)
InChIKeyZDNXFOSAOSWFJQ-UHFFFAOYSA-N
MW444.49 g/mol
LogP4.98
Rot. Bonds6

About 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide

1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 3936641) has the molecular formula C26H24N2O5 and a molecular weight of 444.49 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID3936641
Molecular FormulaC26H24N2O5
Molecular Weight444.49 g/mol
Exact Mass444.17
IUPAC Name1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCCOc1ccccc1N1CC(C(=O)Nc2cc3oc4ccccc4c3cc2OC)CC1=O
InChIInChI=1S/C26H24N2O5/c1-3-32-22-11-7-5-9-20(22)28-15-16(12-25(28)29)26(30)27-19-14-23-18(13-24(19)31-2)17-8-4-6-10-21(17)33-23/h4-11,13-14,16H,3,12,15H2,1-2H3,(H,27,30)
InChIKeyZDNXFOSAOSWFJQ-UHFFFAOYSA-N
XLogP4.98
TPSA81.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.49
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3S)-1-(2-ethoxyphenyl)-N-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 2684734
(3R)-1-(2-ethoxyphenyl)-N-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 26087224
1-(2-ethoxyphenyl)-N-(2-hydroxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 18886193
1-(2-ethoxyphenyl)-5-oxo-N-(2-pyrrolidin-1-ylphenyl)pyrrolidine-3-carboxamide
CID 24980846
(3R)-1-(2-ethoxyphenyl)-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 25345375
(3R)-N-(2,5-difluorophenyl)-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 40942309
1-(2-ethoxyphenyl)-5-oxo-N-(2-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 43008551
(3S)-N-(2,5-dichlorophenyl)-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 1260559
(3R)-N-(2,3-dimethylphenyl)-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 2599596
(3S)-1-(2-ethoxyphenyl)-N-[(2-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 2713254
(3S)-N-(2-chloro-4-methylphenyl)-1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 8885855
(3R)-N-(2-methoxy-5-methylphenyl)-1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 9098300

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide (CID 3936641) is 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide is CCOc1ccccc1N1CC(C(=O)Nc2cc3oc4ccccc4c3cc2OC)CC1=O.
What is the InChIKey of 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is ZDNXFOSAOSWFJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O5/c1-3-32-22-11-7-5-9-20(22)28-15-16(12-25(28)29)26(30)27-19-14-23-18(13-24(19)31-2)17-8-4-6-10-21(17)33-23/h4-11,13-14,16H,3,12,15H2,1-2H3,(H,27,30).
What are the key properties of 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide?
1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 444.49 g/mol, XLogP of 4.98, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-N-(2-methoxydibenzofuran-3-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 3936641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).