2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide

C14H29NO4 — CID 155190113

IUPAC2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide
SMILESCCCCNC(=O)COCCOCCOCCCC
InChIInChI=1S/C14H29NO4/c1-3-5-7-15-14(16)13-19-12-11-18-10-9-17-8-6-4-2/h3-13H2,1-2H3,(H,15,16)
InChIKeyLBAJVXCRVYYICK-UHFFFAOYSA-N
MW275.39 g/mol
LogP1.75
Rot. Bonds14

About 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide

2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide (PubChem CID 155190113) has the molecular formula C14H29NO4 and a molecular weight of 275.39 g/mol. Its IUPAC name is 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide.

Molecular Properties

Compound Name2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide
PubChem CID155190113
Molecular FormulaC14H29NO4
Molecular Weight275.39 g/mol
Exact Mass275.21
IUPAC Name2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide
SMILESCCCCNC(=O)COCCOCCOCCCC
InChIInChI=1S/C14H29NO4/c1-3-5-7-15-14(16)13-19-12-11-18-10-9-17-8-6-4-2/h3-13H2,1-2H3,(H,15,16)
InChIKeyLBAJVXCRVYYICK-UHFFFAOYSA-N
XLogP1.75
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-butoxyethoxy)-N-(2-hydroxyethyl)acetamide
CID 89471630
N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide
CID 89176591
N-butyl-2-[2-(4-methylpentoxy)ethoxy]acetamide
CID 156795089
2-[2-[2-[5-[[2-(2-butoxyethoxy)acetyl]amino]pentoxy]ethoxy]ethoxy]-N-methylacetamide
CID 134582817
2-(2-butoxyethoxy)-N-(4-methylpentyl)acetamide
CID 148767306
N-[2-[2-[2-[2-[2-[2-(butylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]butanamide
CID 89176712
N-[2-[2-[2-[2-[2-[2-[2-[2-(butylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxymethyl]propanamide
CID 137465988
N-[2-[2-[2-[2-[2-[2-(butylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]heptanamide
CID 89417865
2-(2-aminoethoxy)-N-butylacetamide
CID 62343440
N'-(3-butoxypropyl)-N-butylbutanediamide
CID 4602776
N-(2-hydroxyethyl)-2-(2-tridecoxyethoxy)acetamide
CID 100965697
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide;ethane;methane
CID 178085327

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide?
The IUPAC name of 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide (CID 155190113) is 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide.
What is the SMILES notation for 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide?
The canonical SMILES for 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide is CCCCNC(=O)COCCOCCOCCCC.
What is the InChIKey of 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide?
The InChIKey is LBAJVXCRVYYICK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO4/c1-3-5-7-15-14(16)13-19-12-11-18-10-9-17-8-6-4-2/h3-13H2,1-2H3,(H,15,16).
What are the key properties of 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide?
2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide has a molecular weight of 275.39 g/mol, XLogP of 1.75, 14 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide is sourced from PubChem (CID 155190113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).