2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide

C14H30N2O5 — CID 106237751

IUPAC2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide
SMILESCCCCOCCOCCOCCNCCOCC(N)=O
InChIInChI=1S/C14H30N2O5/c1-2-3-6-18-9-11-20-12-10-19-7-4-16-5-8-21-13-14(15)17/h16H,2-13H2,1H3,(H2,15,17)
InChIKeyNANWHLBBYWGQCD-UHFFFAOYSA-N
MW306.40 g/mol
LogP-0.07
Rot. Bonds17

About 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide

2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide (PubChem CID 106237751) has the molecular formula C14H30N2O5 and a molecular weight of 306.40 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide
PubChem CID106237751
Molecular FormulaC14H30N2O5
Molecular Weight306.40 g/mol
Exact Mass306.22
IUPAC Name2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide
SMILESCCCCOCCOCCOCCNCCOCC(N)=O
InChIInChI=1S/C14H30N2O5/c1-2-3-6-18-9-11-20-12-10-19-7-4-16-5-8-21-13-14(15)17/h16H,2-13H2,1H3,(H2,15,17)
InChIKeyNANWHLBBYWGQCD-UHFFFAOYSA-N
XLogP-0.07
TPSA92.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.40
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide?
The IUPAC name of 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide (CID 106237751) is 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide is CCCCOCCOCCOCCNCCOCC(N)=O.
What is the InChIKey of 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide?
The InChIKey is NANWHLBBYWGQCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O5/c1-2-3-6-18-9-11-20-12-10-19-7-4-16-5-8-21-13-14(15)17/h16H,2-13H2,1H3,(H2,15,17).
What are the key properties of 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide?
2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide has a molecular weight of 306.40 g/mol, XLogP of -0.07, 17 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethylamino]ethoxy]acetamide is sourced from PubChem (CID 106237751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).