3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid

C11H23NO4 — CID 103224638

IUPAC3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid
SMILESCOCCN(CC(C)C)C(COC)C(=O)O
InChIInChI=1S/C11H23NO4/c1-9(2)7-12(5-6-15-3)10(8-16-4)11(13)14/h9-10H,5-8H2,1-4H3,(H,13,14)
InChIKeyHXGGORWKHPCGSE-UHFFFAOYSA-N
MW233.31 g/mol
LogP0.69
Rot. Bonds9

About 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid

3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid (PubChem CID 103224638) has the molecular formula C11H23NO4 and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid.

Molecular Properties

Compound Name3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid
PubChem CID103224638
Molecular FormulaC11H23NO4
Molecular Weight233.31 g/mol
Exact Mass233.16
IUPAC Name3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid
SMILESCOCCN(CC(C)C)C(COC)C(=O)O
InChIInChI=1S/C11H23NO4/c1-9(2)7-12(5-6-15-3)10(8-16-4)11(13)14/h9-10H,5-8H2,1-4H3,(H,13,14)
InChIKeyHXGGORWKHPCGSE-UHFFFAOYSA-N
XLogP0.69
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-cyanoethyl(2-methylpropyl)amino]-3-methoxypropanoic acid
CID 103224696
2-[(2-amino-2-oxoethyl)-(2-methylpropyl)amino]-3-methoxypropanoic acid
CID 103224684
2-[2-methoxyethyl(2-methylpropyl)amino]propanamide
CID 62901426
2-[2-methoxyethyl(methyl)amino]-4-methylpentanoic acid
CID 18426364
3-[2-methoxyethyl(2-methylpropyl)amino]-2-methyl-3-oxopropanoic acid
CID 114897540
3-methoxy-2-[[2-methoxyethyl(2-methylpropyl)carbamoyl]amino]propanoic acid
CID 81086313
3-[bis(2-methoxyethyl)amino]-2-methylpropanoic acid
CID 61418249
2-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butanoic acid
CID 63055687
3-methoxy-2-[propyl(2,2,2-trifluoroethyl)amino]propanoic acid
CID 103224693
N-(2-methoxyethyl)-N-(2-methylpropyl)carbamoyl chloride
CID 79886466
4-[2-methoxyethyl(2-methylpropyl)amino]-2-methyl-2-(methylamino)pentanamide
CID 64711225
2-[[2-methoxyethyl(propan-2-yl)carbamoyl]-methylamino]butanoic acid
CID 82951996

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid?
The IUPAC name of 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid (CID 103224638) is 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid.
What is the SMILES notation for 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid?
The canonical SMILES for 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid is COCCN(CC(C)C)C(COC)C(=O)O.
What is the InChIKey of 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid?
The InChIKey is HXGGORWKHPCGSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO4/c1-9(2)7-12(5-6-15-3)10(8-16-4)11(13)14/h9-10H,5-8H2,1-4H3,(H,13,14).
What are the key properties of 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid?
3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid has a molecular weight of 233.31 g/mol, XLogP of 0.69, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-[2-methoxyethyl(2-methylpropyl)amino]propanoic acid is sourced from PubChem (CID 103224638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).