3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide

C17H28N2O7 — CID 59365004

IUPAC3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide
SMILESCCOCCOCCOCCOCCNC(=O)CCN1C(=O)C=CC1=O
InChIInChI=1S/C17H28N2O7/c1-2-23-9-10-25-13-14-26-12-11-24-8-6-18-15(20)5-7-19-16(21)3-4-17(19)22/h3-4H,2,5-14H2,1H3,(H,18,20)
InChIKeyZLFOWOFYEIDQGI-UHFFFAOYSA-N
MW372.42 g/mol
LogP-0.50
Rot. Bonds16

About 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide

3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide (PubChem CID 59365004) has the molecular formula C17H28N2O7 and a molecular weight of 372.42 g/mol. Its IUPAC name is 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide.

Molecular Properties

Compound Name3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide
PubChem CID59365004
Molecular FormulaC17H28N2O7
Molecular Weight372.42 g/mol
Exact Mass372.19
IUPAC Name3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide
SMILESCCOCCOCCOCCOCCNC(=O)CCN1C(=O)C=CC1=O
InChIInChI=1S/C17H28N2O7/c1-2-23-9-10-25-13-14-26-12-11-24-8-6-18-15(20)5-7-19-16(21)3-4-17(19)22/h3-4H,2,5-14H2,1H3,(H,18,20)
InChIKeyZLFOWOFYEIDQGI-UHFFFAOYSA-N
XLogP-0.50
TPSA103.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide?
The IUPAC name of 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide (CID 59365004) is 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide.
What is the SMILES notation for 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide?
The canonical SMILES for 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide is CCOCCOCCOCCOCCNC(=O)CCN1C(=O)C=CC1=O.
What is the InChIKey of 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide?
The InChIKey is ZLFOWOFYEIDQGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O7/c1-2-23-9-10-25-13-14-26-12-11-24-8-6-18-15(20)5-7-19-16(21)3-4-17(19)22/h3-4H,2,5-14H2,1H3,(H,18,20).
What are the key properties of 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide?
3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide has a molecular weight of 372.42 g/mol, XLogP of -0.50, 16 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dioxopyrrol-1-yl)-N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]propanamide is sourced from PubChem (CID 59365004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).