N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide

C9H17NO5 — CID 155596113

IUPACN-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide
SMILESCC(=O)COCCOCC(=O)NCCO
InChIInChI=1S/C9H17NO5/c1-8(12)6-14-4-5-15-7-9(13)10-2-3-11/h11H,2-7H2,1H3,(H,10,13)
InChIKeyQRXKNHIQABRQFB-UHFFFAOYSA-N
MW219.24 g/mol
LogP-1.28
Rot. Bonds9

About N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide

N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide (PubChem CID 155596113) has the molecular formula C9H17NO5 and a molecular weight of 219.24 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide
PubChem CID155596113
Molecular FormulaC9H17NO5
Molecular Weight219.24 g/mol
Exact Mass219.11
IUPAC NameN-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide
SMILESCC(=O)COCCOCC(=O)NCCO
InChIInChI=1S/C9H17NO5/c1-8(12)6-14-4-5-15-7-9(13)10-2-3-11/h11H,2-7H2,1H3,(H,10,13)
InChIKeyQRXKNHIQABRQFB-UHFFFAOYSA-N
XLogP-1.28
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 5-1.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-oxopropoxy)ethoxy]-N-[2-(2-oxopropoxy)ethyl]acetamide
CID 169276802
[2-[2-[2-(2-hydroxyethylamino)-2-oxoethoxy]ethoxy]acetyl]azanide;yttrium
CID 155596009
2-[2-[2-(methylamino)ethoxy]ethoxy]-N-[2-[2-[2-oxo-2-[2-[2-[2-oxo-2-[2-[2-[2-oxo-2-[2-[2-[2-oxo-2-[2-[2-(2-oxopropoxy)ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethyl]acetamide
CID 59533808
2-(2-butoxyethoxy)-N-(2-hydroxyethyl)acetamide
CID 89471630
N-methyl-2-[2-(2-oxopropoxy)ethoxy]acetamide
CID 59773137
2-[2-(2-hydrazinylethoxy)ethoxy]-N-(2-hydroxyethyl)acetamide
CID 123205236
N-(2-hydroxyethyl)-2-(2-tridecoxyethoxy)acetamide
CID 100965697
2-(2-oxopropoxy)-N-[2-(2-propoxyethoxy)ethyl]acetamide
CID 123445865
N-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-(2-oxopropoxy)acetamide
CID 58238700
2-[2-[2-(2-oxopropoxy)ethoxy]ethoxy]-N-[3-(propan-2-ylamino)propyl]acetamide
CID 146201925
5-oxo-5-[2-[2-[2-oxo-2-[2-[2-(2-oxopropoxy)ethoxy]ethylamino]ethoxy]ethoxy]ethylamino]pentanoic acid
CID 130440881
9-hydroxy-N-[2-[2-[2-[2-(2-oxopropoxy)ethoxy]ethoxy]ethoxy]ethyl]nonanamide;vanadium
CID 155741032

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide (CID 155596113) is N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide is CC(=O)COCCOCC(=O)NCCO.
What is the InChIKey of N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide?
The InChIKey is QRXKNHIQABRQFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO5/c1-8(12)6-14-4-5-15-7-9(13)10-2-3-11/h11H,2-7H2,1H3,(H,10,13).
What are the key properties of N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide?
N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide has a molecular weight of 219.24 g/mol, XLogP of -1.28, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-[2-(2-oxopropoxy)ethoxy]acetamide is sourced from PubChem (CID 155596113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).