N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide

C10H14N2O5 — CID 18339262

IUPACN-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)NCN1C(=O)C=CC1=O
InChIInChI=1S/C10H14N2O5/c1-16-4-5-17-6-8(13)11-7-12-9(14)2-3-10(12)15/h2-3H,4-7H2,1H3,(H,11,13)
InChIKeyPLJHWIGVHSMXJW-UHFFFAOYSA-N
MW242.23 g/mol
LogP-1.35
Rot. Bonds7

About N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide

N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide (PubChem CID 18339262) has the molecular formula C10H14N2O5 and a molecular weight of 242.23 g/mol. Its IUPAC name is N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide
PubChem CID18339262
Molecular FormulaC10H14N2O5
Molecular Weight242.23 g/mol
Exact Mass242.09
IUPAC NameN-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)NCN1C(=O)C=CC1=O
InChIInChI=1S/C10H14N2O5/c1-16-4-5-17-6-8(13)11-7-12-9(14)2-3-10(12)15/h2-3H,4-7H2,1H3,(H,11,13)
InChIKeyPLJHWIGVHSMXJW-UHFFFAOYSA-N
XLogP-1.35
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.23
LogP ≤ 5-1.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminoethyl)-2-[2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]acetamide
CID 21299428
N-[1-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethyl]-2-ethoxypropanamide
CID 59156932
1-[1-Amino-2-[2-(2-aminoethoxy)ethoxy]ethyl]pyrrole-2,5-dione
CID 67646154
2-[2-[2-(2,5-Dioxopyrrol-1-yl)ethoxy]ethoxy]acetamide
CID 69116680
N-[2-(2,5-dioxopyrrol-1-yl)ethyl]-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetamide
CID 70930935
2-aminooxy-N-[2-[2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]ethyl]acetamide
CID 90196811
N-[2-[2-[2-[2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-methoxyacetamide
CID 154586738
2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]-N-methylacetamide
CID 174253875
1-[2-[2-[2-(Propan-2-ylamino)ethoxy]ethoxy]acetyl]pyrrole-2,5-dione
CID 176860529
2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-[2-(2,5-dioxopyrrol-1-yl)ethyl]acetamide
CID 158047533

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide (CID 18339262) is N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide is COCCOCC(=O)NCN1C(=O)C=CC1=O.
What is the InChIKey of N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide?
The InChIKey is PLJHWIGVHSMXJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O5/c1-16-4-5-17-6-8(13)11-7-12-9(14)2-3-10(12)15/h2-3H,4-7H2,1H3,(H,11,13).
What are the key properties of N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide?
N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide has a molecular weight of 242.23 g/mol, XLogP of -1.35, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dioxopyrrol-1-yl)methyl]-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 18339262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).