3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide

C21H24N2O4 — CID 26955412

IUPAC3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide
SMILESCCOc1ccccc1OCCC(=O)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C21H24N2O4/c1-2-26-18-10-5-6-11-19(18)27-15-13-20(24)22-16-8-3-4-9-17(16)23-14-7-12-21(23)25/h3-6,8-11H,2,7,12-15H2,1H3,(H,22,24)
InChIKeyMYNMMMDMAUXZRT-UHFFFAOYSA-N
MW368.43 g/mol
LogP3.62
Rot. Bonds8

About 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide

3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide (PubChem CID 26955412) has the molecular formula C21H24N2O4 and a molecular weight of 368.43 g/mol. Its IUPAC name is 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide.

Molecular Properties

Compound Name3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide
PubChem CID26955412
Molecular FormulaC21H24N2O4
Molecular Weight368.43 g/mol
Exact Mass368.17
IUPAC Name3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide
SMILESCCOc1ccccc1OCCC(=O)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C21H24N2O4/c1-2-26-18-10-5-6-11-19(18)27-15-13-20(24)22-16-8-3-4-9-17(16)23-14-7-12-21(23)25/h3-6,8-11H,2,7,12-15H2,1H3,(H,22,24)
InChIKeyMYNMMMDMAUXZRT-UHFFFAOYSA-N
XLogP3.62
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The IUPAC name of 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide (CID 26955412) is 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide.
What is the SMILES notation for 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The canonical SMILES for 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide is CCOc1ccccc1OCCC(=O)Nc1ccccc1N1CCCC1=O.
What is the InChIKey of 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The InChIKey is MYNMMMDMAUXZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O4/c1-2-26-18-10-5-6-11-19(18)27-15-13-20(24)22-16-8-3-4-9-17(16)23-14-7-12-21(23)25/h3-6,8-11H,2,7,12-15H2,1H3,(H,22,24).
What are the key properties of 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide has a molecular weight of 368.43 g/mol, XLogP of 3.62, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide is sourced from PubChem (CID 26955412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).