2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C15H21N3O3 — CID 112722629

IUPAC2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOCCNCC(=O)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C15H21N3O3/c1-21-10-8-16-11-14(19)17-12-5-2-3-6-13(12)18-9-4-7-15(18)20/h2-3,5-6,16H,4,7-11H2,1H3,(H,17,19)
InChIKeyFTNXZYBEWLGVDO-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.99
Rot. Bonds7

About 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 112722629) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID112722629
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCOCCNCC(=O)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C15H21N3O3/c1-21-10-8-16-11-14(19)17-12-5-2-3-6-13(12)18-9-4-7-15(18)20/h2-3,5-6,16H,4,7-11H2,1H3,(H,17,19)
InChIKeyFTNXZYBEWLGVDO-UHFFFAOYSA-N
XLogP0.99
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 112722629) is 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is COCCNCC(=O)Nc1ccccc1N1CCCC1=O.
What is the InChIKey of 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is FTNXZYBEWLGVDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-21-10-8-16-11-14(19)17-12-5-2-3-6-13(12)18-9-4-7-15(18)20/h2-3,5-6,16H,4,7-11H2,1H3,(H,17,19).
What are the key properties of 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 291.35 g/mol, XLogP of 0.99, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 112722629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).