2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C19H19FN2O4 — CID 7687155

IUPAC2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
InChIInChI=1S/C19H19FN2O4/c1-25-17-9-8-13(11-15(17)22-10-4-7-19(22)24)21-18(23)12-26-16-6-3-2-5-14(16)20/h2-3,5-6,8-9,11H,4,7,10,12H2,1H3,(H,21,23)
InChIKeyNYGKJPVNALKJLI-UHFFFAOYSA-N
MW358.37 g/mol
LogP2.98
Rot. Bonds6

About 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide

2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 7687155) has the molecular formula C19H19FN2O4 and a molecular weight of 358.37 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID7687155
Molecular FormulaC19H19FN2O4
Molecular Weight358.37 g/mol
Exact Mass358.13
IUPAC Name2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O
InChIInChI=1S/C19H19FN2O4/c1-25-17-9-8-13(11-15(17)22-10-4-7-19(22)24)21-18(23)12-26-16-6-3-2-5-14(16)20/h2-3,5-6,8-9,11H,4,7,10,12H2,1H3,(H,21,23)
InChIKeyNYGKJPVNALKJLI-UHFFFAOYSA-N
XLogP2.98
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.37
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 7687155) is 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide is COc1ccc(NC(=O)COc2ccccc2F)cc1N1CCCC1=O.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is NYGKJPVNALKJLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O4/c1-25-17-9-8-13(11-15(17)22-10-4-7-19(22)24)21-18(23)12-26-16-6-3-2-5-14(16)20/h2-3,5-6,8-9,11H,4,7,10,12H2,1H3,(H,21,23).
What are the key properties of 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 358.37 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 7687155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).