N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide

C11H21NO5 — CID 163401026

IUPACN-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide
SMILESCCC(=O)NCCOCCOCCOCC=O
InChIInChI=1S/C11H21NO5/c1-2-11(14)12-3-5-15-7-9-17-10-8-16-6-4-13/h4H,2-3,5-10H2,1H3,(H,12,14)
InChIKeyUFYKRLZOLKHWOC-UHFFFAOYSA-N
MW247.29 g/mol
LogP-0.24
Rot. Bonds12

About N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide

N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide (PubChem CID 163401026) has the molecular formula C11H21NO5 and a molecular weight of 247.29 g/mol. Its IUPAC name is N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide.

Molecular Properties

Compound NameN-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide
PubChem CID163401026
Molecular FormulaC11H21NO5
Molecular Weight247.29 g/mol
Exact Mass247.14
IUPAC NameN-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide
SMILESCCC(=O)NCCOCCOCCOCC=O
InChIInChI=1S/C11H21NO5/c1-2-11(14)12-3-5-15-7-9-17-10-8-16-6-4-13/h4H,2-3,5-10H2,1H3,(H,12,14)
InChIKeyUFYKRLZOLKHWOC-UHFFFAOYSA-N
XLogP-0.24
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-acetamidoacetic acid;N-[2-[2-[2-oxo-2-[2-[2-(2-oxoethoxy)ethoxy]ethylamino]ethoxy]ethoxy]ethyl]propanamide
CID 142338805
N-[2-[2-[2-(ethylamino)ethoxy]ethoxy]ethyl]propanamide
CID 147425516
2-butoxy-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]acetamide
CID 172626027
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]propanamide
CID 122664379
N-[2-[2-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-sulfanylpropanamide
CID 57182546
N-[2-[2-[2-[2-(propanoylamino)ethoxy]ethoxy]ethoxy]ethyl]pentanamide
CID 167513156
5-oxo-5-[2-[2-(2-oxoethoxy)ethoxy]ethylamino]pentanoic acid
CID 144843622
N-[2-(2-butoxyethoxy)ethyl]propanamide
CID 153105198
N-[2-[2-(2-bromoethoxy)ethoxy]ethyl]propanamide
CID 154729990
N-(2-ethoxyethyl)-2-(2-oxoethoxy)acetamide
CID 139515963
molecular hydrogen;N-(2-propoxyethyl)propanamide
CID 170639851
N-methyl-3-[2-[2-(propanoylamino)ethoxy]ethoxy]propanamide
CID 163393368

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide?
The IUPAC name of N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide (CID 163401026) is N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide.
What is the SMILES notation for N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide?
The canonical SMILES for N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide is CCC(=O)NCCOCCOCCOCC=O.
What is the InChIKey of N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide?
The InChIKey is UFYKRLZOLKHWOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO5/c1-2-11(14)12-3-5-15-7-9-17-10-8-16-6-4-13/h4H,2-3,5-10H2,1H3,(H,12,14).
What are the key properties of N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide?
N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide has a molecular weight of 247.29 g/mol, XLogP of -0.24, 12 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]ethyl]propanamide is sourced from PubChem (CID 163401026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).