3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate

C10H21NO4 — CID 103403303

IUPAC3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate
SMILESCOCCOCCCOC(=O)C(C)(C)N
InChIInChI=1S/C10H21NO4/c1-10(2,11)9(12)15-6-4-5-14-8-7-13-3/h4-8,11H2,1-3H3
InChIKeyFQSBNUWQVJGFBH-UHFFFAOYSA-N
MW219.28 g/mol
LogP0.32
Rot. Bonds8

About 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate

3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate (PubChem CID 103403303) has the molecular formula C10H21NO4 and a molecular weight of 219.28 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate.

Molecular Properties

Compound Name3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate
PubChem CID103403303
Molecular FormulaC10H21NO4
Molecular Weight219.28 g/mol
Exact Mass219.15
IUPAC Name3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate
SMILESCOCCOCCCOC(=O)C(C)(C)N
InChIInChI=1S/C10H21NO4/c1-10(2,11)9(12)15-6-4-5-14-8-7-13-3/h4-8,11H2,1-3H3
InChIKeyFQSBNUWQVJGFBH-UHFFFAOYSA-N
XLogP0.32
TPSA70.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-(2-methoxyethoxy)propyl 2-amino-2-methylbutanoate
CID 103403485
2-(3-methoxypropoxy)ethyl 2-amino-2-methylpentanoate
CID 103178593
3-(2-methoxyethoxy)propyl 2-methoxyethyl carbonate
CID 87247503
methyl 3-[3-(2-methoxyethoxy)propoxy]-2,2-dimethylpropanoate
CID 103400749
3-methoxypropyl 3-amino-2,2,3-trimethylbutanoate
CID 65266255
2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-bromo-2-methylpropanoate
CID 11038281
2-[2-[3-[2-(2-methoxyethoxy)ethoxy]propoxy]ethoxy]ethanamine
CID 146320426
2-[2-[3-(2-methoxyethoxy)propoxy]ethoxy]ethanamine
CID 103482612
2-amino-5-[3-(2-methoxyethoxy)propoxy]-2-methylpentan-1-ol
CID 103407415
3-[2-(2-methoxyethoxy)ethoxy]propyl N-methylcarbamate
CID 177295921
ethyl 3-(2-methoxyethoxy)propyl carbonate
CID 87247585
methyl 2-amino-2-cyclopropyl-3-[3-(2-methoxyethoxy)propoxy]propanoate
CID 103404790

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate?
The IUPAC name of 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate (CID 103403303) is 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate.
What is the SMILES notation for 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate?
The canonical SMILES for 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate is COCCOCCCOC(=O)C(C)(C)N.
What is the InChIKey of 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate?
The InChIKey is FQSBNUWQVJGFBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO4/c1-10(2,11)9(12)15-6-4-5-14-8-7-13-3/h4-8,11H2,1-3H3.
What are the key properties of 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate?
3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate has a molecular weight of 219.28 g/mol, XLogP of 0.32, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)propyl 2-amino-2-methylpropanoate is sourced from PubChem (CID 103403303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).