3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid

C10H19NO4 — CID 117008804

IUPAC3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid
SMILESCOCCN1CCOC(CCC(=O)O)C1
InChIInChI=1S/C10H19NO4/c1-14-6-4-11-5-7-15-9(8-11)2-3-10(12)13/h9H,2-8H2,1H3,(H,12,13)
InChIKeyCZIGBQHCTPODEP-UHFFFAOYSA-N
MW217.26 g/mol
LogP0.20
Rot. Bonds6

About 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid

3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid (PubChem CID 117008804) has the molecular formula C10H19NO4 and a molecular weight of 217.26 g/mol. Its IUPAC name is 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid.

Molecular Properties

Compound Name3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid
PubChem CID117008804
Molecular FormulaC10H19NO4
Molecular Weight217.26 g/mol
Exact Mass217.13
IUPAC Name3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid
SMILESCOCCN1CCOC(CCC(=O)O)C1
InChIInChI=1S/C10H19NO4/c1-14-6-4-11-5-7-15-9(8-11)2-3-10(12)13/h9H,2-8H2,1H3,(H,12,13)
InChIKeyCZIGBQHCTPODEP-UHFFFAOYSA-N
XLogP0.20
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2S)-4-ethylmorpholin-2-yl]propanoic acid
CID 95426355
2-[4-[2-(2-methoxyethoxy)ethyl]morpholin-2-yl]acetic acid
CID 66434854
ethane;3-[(2R)-4-methylmorpholin-2-yl]propanoic acid
CID 145006678
2-(chloromethyl)-4-(2-methoxyethyl)morpholine
CID 71380067
2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone
CID 131914885
methyl 2-[4-(2-morpholin-4-ylethyl)morpholin-2-yl]acetate
CID 79822697
methyl 4-[2-(aminomethyl)morpholin-4-yl]butanoate
CID 114398668
3-[4-(2-methoxyethyl)morpholin-3-yl]propanoic acid
CID 117009385
2-(bromomethyl)-4-[3-(2-methoxyethoxy)propyl]morpholine
CID 103413126
methyl 2-[4-[2-(3-methylbutoxy)ethyl]morpholin-2-yl]acetate
CID 79823416
2-[4-[4-(methylamino)-4-oxobutyl]morpholin-2-yl]acetic acid
CID 66434649
2-[4-(4-methylpentyl)morpholin-2-yl]acetic acid
CID 83158040

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid?
The IUPAC name of 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid (CID 117008804) is 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid.
What is the SMILES notation for 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid?
The canonical SMILES for 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid is COCCN1CCOC(CCC(=O)O)C1.
What is the InChIKey of 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid?
The InChIKey is CZIGBQHCTPODEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO4/c1-14-6-4-11-5-7-15-9(8-11)2-3-10(12)13/h9H,2-8H2,1H3,(H,12,13).
What are the key properties of 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid?
3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid has a molecular weight of 217.26 g/mol, XLogP of 0.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid is sourced from PubChem (CID 117008804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).