3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate

C10H21NO5 — CID 107825441

IUPAC3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate
SMILESCOCCOCCCOC(=O)[C@H](N)CCO
InChIInChI=1S/C10H21NO5/c1-14-7-8-15-5-2-6-16-10(13)9(11)3-4-12/h9,12H,2-8,11H2,1H3/t9-/m1/s1
InChIKeyIYATUYHWYQPSJZ-SECBINFHSA-N
MW235.28 g/mol
LogP-0.71
Rot. Bonds10

About 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate

3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate (PubChem CID 107825441) has the molecular formula C10H21NO5 and a molecular weight of 235.28 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate.

Molecular Properties

Compound Name3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate
PubChem CID107825441
Molecular FormulaC10H21NO5
Molecular Weight235.28 g/mol
Exact Mass235.14
IUPAC Name3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate
SMILESCOCCOCCCOC(=O)[C@H](N)CCO
InChIInChI=1S/C10H21NO5/c1-14-7-8-15-5-2-6-16-10(13)9(11)3-4-12/h9,12H,2-8,11H2,1H3/t9-/m1/s1
InChIKeyIYATUYHWYQPSJZ-SECBINFHSA-N
XLogP-0.71
TPSA91.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 5-0.71
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
2-(2-methoxyethoxy)ethyl (2R)-2-amino-4-hydroxybutanoate
CID 107825427
2-[2-(2-butoxyethoxy)ethoxy]ethyl 2-amino-4-hydroxybutanoate
CID 104563663
3-(2-methoxyethoxy)propyl 3-amino-2-methylbutanoate
CID 103403540
2-(2-methoxyethoxy)ethyl 2,6-diaminohexanoate
CID 162501240
2-amino-4-[3-(2-methoxyethoxy)propoxy]butanoic acid
CID 103404603
3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-(2-methoxyethoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 155650334
2-[2-(2-methoxyethoxy)ethoxy]ethyl (2S)-2-amino-4-methylsulfanylbutanoate
CID 87305409
2-(3-methoxypropoxy)ethyl 6-amino-2-methylheptanoate
CID 103178676
2-amino-3-[3-(2-methoxyethoxy)propoxy]propanamide
CID 103400791
3-(2-methoxyethoxy)propyl 2-methoxyethyl carbonate
CID 87247503
3-(2-methoxyethoxy)propyl (2R)-2-amino-3-(4-hydroxyphenyl)propanoate
CID 103403094

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate?
The IUPAC name of 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate (CID 107825441) is 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate.
What is the SMILES notation for 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate?
The canonical SMILES for 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate is COCCOCCCOC(=O)[C@H](N)CCO.
What is the InChIKey of 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate?
The InChIKey is IYATUYHWYQPSJZ-SECBINFHSA-N. The full InChI is InChI=1S/C10H21NO5/c1-14-7-8-15-5-2-6-16-10(13)9(11)3-4-12/h9,12H,2-8,11H2,1H3/t9-/m1/s1.
What are the key properties of 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate?
3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate has a molecular weight of 235.28 g/mol, XLogP of -0.71, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)propyl (2R)-2-amino-4-hydroxybutanoate is sourced from PubChem (CID 107825441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).