2-(2-oxomorpholin-4-yl)acetic acid

C6H9NO4 — CID 1415538

IUPAC2-(2-oxomorpholin-4-yl)acetic acid
SMILESO=C(O)CN1CCOC(=O)C1
InChIInChI=1S/C6H9NO4/c8-5(9)3-7-1-2-11-6(10)4-7/h1-4H2,(H,8,9)
InChIKeyRCYMJALINOFPDJ-UHFFFAOYSA-N
MW159.14 g/mol
LogP-1.07
Rot. Bonds2

About 2-(2-oxomorpholin-4-yl)acetic acid

2-(2-oxomorpholin-4-yl)acetic acid (PubChem CID 1415538) has the molecular formula C6H9NO4 and a molecular weight of 159.14 g/mol. Its IUPAC name is 2-(2-oxomorpholin-4-yl)acetic acid.

Molecular Properties

Compound Name2-(2-oxomorpholin-4-yl)acetic acid
PubChem CID1415538
Molecular FormulaC6H9NO4
Molecular Weight159.14 g/mol
Exact Mass159.05
IUPAC Name2-(2-oxomorpholin-4-yl)acetic acid
SMILESO=C(O)CN1CCOC(=O)C1
InChIInChI=1S/C6H9NO4/c8-5(9)3-7-1-2-11-6(10)4-7/h1-4H2,(H,8,9)
InChIKeyRCYMJALINOFPDJ-UHFFFAOYSA-N
XLogP-1.07
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 5-1.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-Morpholineacetic acid
CID 438968
Methyl Morpholinoacetate
CID 1268178
2-(4-Methylmorpholin-4-ium-4-yl)acetate
CID 5249656
Ethyl 2-Morpholinoacetate
CID 2734105
(Morpholin-4-yl)(oxo)acetic acid
CID 15401443
Morpholine, 4-methyl-, acetate (1:1)
CID 44149666
2-(Morpholin-4-yl)acetic acid hydrochloride
CID 17750946
4-(Carboxymethyl)-4-methylmorpholin-4-ium chloride
CID 44367147
Methyl morpholine-4-acetate hydrochloride
CID 44119789
2-(3-Oxomorpholin-4-yl)acetic acid
CID 50990566
2,6-dioxo-N-(carboxymethyl)morpholine
CID 169531
Nitrilotriacetic acid monoethyl ester
CID 54043700

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxomorpholin-4-yl)acetic acid?
The IUPAC name of 2-(2-oxomorpholin-4-yl)acetic acid (CID 1415538) is 2-(2-oxomorpholin-4-yl)acetic acid.
What is the SMILES notation for 2-(2-oxomorpholin-4-yl)acetic acid?
The canonical SMILES for 2-(2-oxomorpholin-4-yl)acetic acid is O=C(O)CN1CCOC(=O)C1.
What is the InChIKey of 2-(2-oxomorpholin-4-yl)acetic acid?
The InChIKey is RCYMJALINOFPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO4/c8-5(9)3-7-1-2-11-6(10)4-7/h1-4H2,(H,8,9).
What are the key properties of 2-(2-oxomorpholin-4-yl)acetic acid?
2-(2-oxomorpholin-4-yl)acetic acid has a molecular weight of 159.14 g/mol, XLogP of -1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxomorpholin-4-yl)acetic acid is sourced from PubChem (CID 1415538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).