N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide

C13H14N2O4 — CID 71426145

IUPACN-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OCN2C(=O)CCC2=O)cc1
InChIInChI=1S/C13H14N2O4/c1-9(16)14-10-2-4-11(5-3-10)19-8-15-12(17)6-7-13(15)18/h2-5H,6-8H2,1H3,(H,14,16)
InChIKeyTXTXYQOPPLYUMQ-UHFFFAOYSA-N
MW262.26 g/mol
LogP1.13
Rot. Bonds4

About N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide

N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide (PubChem CID 71426145) has the molecular formula C13H14N2O4 and a molecular weight of 262.26 g/mol. Its IUPAC name is N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide
PubChem CID71426145
Molecular FormulaC13H14N2O4
Molecular Weight262.26 g/mol
Exact Mass262.10
IUPAC NameN-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OCN2C(=O)CCC2=O)cc1
InChIInChI=1S/C13H14N2O4/c1-9(16)14-10-2-4-11(5-3-10)19-8-15-12(17)6-7-13(15)18/h2-5H,6-8H2,1H3,(H,14,16)
InChIKeyTXTXYQOPPLYUMQ-UHFFFAOYSA-N
XLogP1.13
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[4-[2-oxo-2-(4-oxopiperidin-1-yl)ethoxy]phenyl]acetamide
CID 62029121
N-(4-acetamidophenyl)-11-(2,5-dioxopyrrolidin-1-yl)undecanamide
CID 17035141
2-(4-acetamidophenoxy)-N-(4-acetamidophenyl)acetamide
CID 7203623
N-[4-(3-chloropropoxy)phenyl]acetamide
CID 5147668
N-[4-[3-(4-acetamidophenoxy)-2-[(4-acetamidophenoxy)methyl]-2-hydroxypropoxy]phenyl]acetamide;hydrate
CID 139075586
N-[4-(2-hydroxy-2-methylpropoxy)phenyl]acetamide
CID 60879910
N-[4-[[(2S)-oxiran-2-yl]methoxy]phenyl]acetamide
CID 737230
N-[4-(2-(113C)ethoxyethoxy)phenyl]acetamide
CID 54301804
1-[(4-methoxyanilino)methyl]pyrrolidine-2,5-dione
CID 748195
N-(4-but-3-enoxyphenyl)acetamide
CID 11195080
2-(4-methoxyphenoxy)ethyl 4-acetamidobenzoate
CID 7654087
N-[4-[2-(4-ethoxyphenoxy)acetyl]phenyl]acetamide
CID 2560779

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide?
The IUPAC name of N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide (CID 71426145) is N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide?
The canonical SMILES for N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide is CC(=O)Nc1ccc(OCN2C(=O)CCC2=O)cc1.
What is the InChIKey of N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide?
The InChIKey is TXTXYQOPPLYUMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4/c1-9(16)14-10-2-4-11(5-3-10)19-8-15-12(17)6-7-13(15)18/h2-5H,6-8H2,1H3,(H,14,16).
What are the key properties of N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide?
N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide has a molecular weight of 262.26 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2,5-dioxopyrrolidin-1-yl)methoxy]phenyl]acetamide is sourced from PubChem (CID 71426145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).