2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate

C9H19NO5 — CID 107825427

IUPAC2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate
SMILESCOCCOCCOC(=O)[C@H](N)CCO
InChIInChI=1S/C9H19NO5/c1-13-4-5-14-6-7-15-9(12)8(10)2-3-11/h8,11H,2-7,10H2,1H3/t8-/m1/s1
InChIKeyVTZGCCOGBMOQHK-MRVPVSSYSA-N
MW221.25 g/mol
LogP-1.10
Rot. Bonds9

About 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate

2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate (PubChem CID 107825427) has the molecular formula C9H19NO5 and a molecular weight of 221.25 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate.

Molecular Properties

Compound Name2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate
PubChem CID107825427
Molecular FormulaC9H19NO5
Molecular Weight221.25 g/mol
Exact Mass221.13
IUPAC Name2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate
SMILESCOCCOCCOC(=O)[C@H](N)CCO
InChIInChI=1S/C9H19NO5/c1-13-4-5-14-6-7-15-9(12)8(10)2-3-11/h8,11H,2-7,10H2,1H3/t8-/m1/s1
InChIKeyVTZGCCOGBMOQHK-MRVPVSSYSA-N
XLogP-1.10
TPSA91.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.25
LogP ≤ 5-1.10
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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Related Compounds

2-[2-(2-methoxyethoxy)ethoxy]ethyl (2R)-2-amino-4-hydroxybutanoate
CID 114005284
3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate
CID 107825441
2-[2-(2-butoxyethoxy)ethoxy]ethyl 2-amino-4-hydroxybutanoate
CID 104563663
2-(2-methoxyethoxy)ethyl 2,6-diaminohexanoate
CID 162501240
2-[2-(2-methoxyethoxy)ethoxy]ethyl (2S)-2-amino-4-methylsulfanylbutanoate
CID 87305409
2-[2-(2-methoxyethoxy)ethoxy]ethyl 3-hydroxy-2-(hydroxymethyl)propanoate
CID 58205614
2-[2-[(2S)-2-amino-4-methylsulfanylbutanoyl]oxyethoxy]ethyl (2S)-2-amino-4-methylsulfanylbutanoate
CID 87587712
(2R)-2-amino-4-[2-(2-methoxyethoxy)ethoxy]butanoic acid
CID 106702905
1-methoxypropan-2-yl (2S)-2-amino-4-hydroxybutanoate
CID 107825394
1-O-[2-(2-hydroxyethoxy)ethyl] 2-O-[2-(2-methoxyethoxy)ethyl] oxalate
CID 89311377
2-propoxyethyl 2-amino-3-hydroxypropanoate
CID 63685229
2-(2-hydroxyethoxy)ethyl 2-amino-4-hydroxypentanoate
CID 156687732

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate?
The IUPAC name of 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate (CID 107825427) is 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate.
What is the SMILES notation for 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate?
The canonical SMILES for 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate is COCCOCCOC(=O)[C@H](N)CCO.
What is the InChIKey of 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate?
The InChIKey is VTZGCCOGBMOQHK-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H19NO5/c1-13-4-5-14-6-7-15-9(12)8(10)2-3-11/h8,11H,2-7,10H2,1H3/t8-/m1/s1.
What are the key properties of 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate?
2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate has a molecular weight of 221.25 g/mol, XLogP of -1.10, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate is sourced from PubChem (CID 107825427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).