5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid

C10H15NO5 — CID 102687423

IUPAC5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid
SMILESO=C(O)C1CCC(C(=O)N2CCOCC2)O1
InChIInChI=1S/C10H15NO5/c12-9(11-3-5-15-6-4-11)7-1-2-8(16-7)10(13)14/h7-8H,1-6H2,(H,13,14)
InChIKeyVGGGLWGQKBUEEY-UHFFFAOYSA-N
MW229.23 g/mol
LogP-0.52
Rot. Bonds2

About 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid

5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid (PubChem CID 102687423) has the molecular formula C10H15NO5 and a molecular weight of 229.23 g/mol. Its IUPAC name is 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid.

Molecular Properties

Compound Name5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid
PubChem CID102687423
Molecular FormulaC10H15NO5
Molecular Weight229.23 g/mol
Exact Mass229.10
IUPAC Name5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid
SMILESO=C(O)C1CCC(C(=O)N2CCOCC2)O1
InChIInChI=1S/C10H15NO5/c12-9(11-3-5-15-6-4-11)7-1-2-8(16-7)10(13)14/h7-8H,1-6H2,(H,13,14)
InChIKeyVGGGLWGQKBUEEY-UHFFFAOYSA-N
XLogP-0.52
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,5S)-5-(4-aminopiperidine-1-carbonyl)oxolane-2-carboxylic acid
CID 102945045
5-(3-methylpyrrolidine-1-carbonyl)oxolane-2-carboxylic acid
CID 102688295
(2R,5S)-5-(4-acetyl-1,4-diazepane-1-carbonyl)oxolane-2-carboxylic acid
CID 102945101
morpholin-4-yl(oxetan-2-yl)methanone
CID 130874953
(2R,5S)-5-(4-propan-2-ylpiperazine-1-carbonyl)oxolane-2-carboxylic acid
CID 102944528
5-(3,5-dimethylpiperidine-1-carbonyl)oxolane-2-carboxylic acid
CID 102687444
(2R,5S)-5-[(3S)-3-hydroxypyrrolidine-1-carbonyl]oxolane-2-carboxylic acid
CID 107214293
(2R,5S)-oxolane-2,5-dicarboxylic acid
CID 12667635
(2R,5S)-5-(morpholin-4-ylcarbamoyl)oxolane-2-carboxylic acid
CID 102945598
(2R,5S)-5-[(3R)-3-methylmorpholine-4-carbonyl]oxolane-2-carboxylic acid
CID 106773953
5-(4-propylpiperazine-1-carbonyl)oxolane-2-carboxylic acid
CID 102687439
5-[4-(2-methoxyacetyl)piperazine-1-carbonyl]oxolane-2-carboxylic acid
CID 102688160

Frequently Asked Questions

What is the IUPAC name of 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid?
The IUPAC name of 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid (CID 102687423) is 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid.
What is the SMILES notation for 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid?
The canonical SMILES for 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid is O=C(O)C1CCC(C(=O)N2CCOCC2)O1.
What is the InChIKey of 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid?
The InChIKey is VGGGLWGQKBUEEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO5/c12-9(11-3-5-15-6-4-11)7-1-2-8(16-7)10(13)14/h7-8H,1-6H2,(H,13,14).
What are the key properties of 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid?
5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid has a molecular weight of 229.23 g/mol, XLogP of -0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid is sourced from PubChem (CID 102687423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).