N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide

C28H51N3O13 — CID 154618555

IUPACN-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide
SMILESNCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CN1C(=O)C=CC1=O
InChIInChI=1S/C28H51N3O13/c29-3-5-35-7-9-37-11-13-39-15-17-41-19-21-43-23-24-44-22-20-42-18-16-40-14-12-38-10-8-36-6-4-30-26(32)25-31-27(33)1-2-28(31)34/h1-2H,3-25,29H2,(H,30,32)
InChIKeySBWIWQVOBVCKME-UHFFFAOYSA-N
MW637.72 g/mol
LogP-1.85
Rot. Bonds34

About N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide

N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide (PubChem CID 154618555) has the molecular formula C28H51N3O13 and a molecular weight of 637.72 g/mol. Its IUPAC name is N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide
PubChem CID154618555
Molecular FormulaC28H51N3O13
Molecular Weight637.72 g/mol
Exact Mass637.34
IUPAC NameN-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide
SMILESNCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CN1C(=O)C=CC1=O
InChIInChI=1S/C28H51N3O13/c29-3-5-35-7-9-37-11-13-39-15-17-41-19-21-43-23-24-44-22-20-42-18-16-40-14-12-38-10-8-36-6-4-30-26(32)25-31-27(33)1-2-28(31)34/h1-2H,3-25,29H2,(H,30,32)
InChIKeySBWIWQVOBVCKME-UHFFFAOYSA-N
XLogP-1.85
TPSA184.80 Ų
H-Bond Donors2
H-Bond Acceptors14
Rotatable Bonds34
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500637.72
LogP ≤ 5-1.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1014

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 N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide?
The IUPAC name of N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide (CID 154618555) is N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide.
What is the SMILES notation for N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide?
The canonical SMILES for N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide is NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CN1C(=O)C=CC1=O.
What is the InChIKey of N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide?
The InChIKey is SBWIWQVOBVCKME-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H51N3O13/c29-3-5-35-7-9-37-11-13-39-15-17-41-19-21-43-23-24-44-22-20-42-18-16-40-14-12-38-10-8-36-6-4-30-26(32)25-31-27(33)1-2-28(31)34/h1-2H,3-25,29H2,(H,30,32).
What are the key properties of N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide?
N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide has a molecular weight of 637.72 g/mol, XLogP of -1.85, 34 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2,5-dioxopyrrol-1-yl)acetamide is sourced from PubChem (CID 154618555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).