5-morpholin-4-yl-4-oxopentanoic acid

C9H15NO4 — CID 67252947

IUPAC5-morpholin-4-yl-4-oxopentanoic acid
SMILESO=C(O)CCC(=O)CN1CCOCC1
InChIInChI=1S/C9H15NO4/c11-8(1-2-9(12)13)7-10-3-5-14-6-4-10/h1-7H2,(H,12,13)
InChIKeyFLDOAXAQSJNRJD-UHFFFAOYSA-N
MW201.22 g/mol
LogP-0.25
Rot. Bonds5

About 5-morpholin-4-yl-4-oxopentanoic acid

5-morpholin-4-yl-4-oxopentanoic acid (PubChem CID 67252947) has the molecular formula C9H15NO4 and a molecular weight of 201.22 g/mol. Its IUPAC name is 5-morpholin-4-yl-4-oxopentanoic acid.

Molecular Properties

Compound Name5-morpholin-4-yl-4-oxopentanoic acid
PubChem CID67252947
Molecular FormulaC9H15NO4
Molecular Weight201.22 g/mol
Exact Mass201.10
IUPAC Name5-morpholin-4-yl-4-oxopentanoic acid
SMILESO=C(O)CCC(=O)CN1CCOCC1
InChIInChI=1S/C9H15NO4/c11-8(1-2-9(12)13)7-10-3-5-14-6-4-10/h1-7H2,(H,12,13)
InChIKeyFLDOAXAQSJNRJD-UHFFFAOYSA-N
XLogP-0.25
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-4-oxopentanoic acid?
The IUPAC name of 5-morpholin-4-yl-4-oxopentanoic acid (CID 67252947) is 5-morpholin-4-yl-4-oxopentanoic acid.
What is the SMILES notation for 5-morpholin-4-yl-4-oxopentanoic acid?
The canonical SMILES for 5-morpholin-4-yl-4-oxopentanoic acid is O=C(O)CCC(=O)CN1CCOCC1.
What is the InChIKey of 5-morpholin-4-yl-4-oxopentanoic acid?
The InChIKey is FLDOAXAQSJNRJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO4/c11-8(1-2-9(12)13)7-10-3-5-14-6-4-10/h1-7H2,(H,12,13).
What are the key properties of 5-morpholin-4-yl-4-oxopentanoic acid?
5-morpholin-4-yl-4-oxopentanoic acid has a molecular weight of 201.22 g/mol, XLogP of -0.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-4-oxopentanoic acid is sourced from PubChem (CID 67252947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).