2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid

C11H18N2O4 — CID 115102549

IUPAC2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid
SMILESO=C(O)C1COC(=O)N1CCN1CCCCC1
InChIInChI=1S/C11H18N2O4/c14-10(15)9-8-17-11(16)13(9)7-6-12-4-2-1-3-5-12/h9H,1-8H2,(H,14,15)
InChIKeyMOIAVZFNDCTOLP-UHFFFAOYSA-N
MW242.27 g/mol
LogP0.38
Rot. Bonds4

About 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid

2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid (PubChem CID 115102549) has the molecular formula C11H18N2O4 and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid.

Molecular Properties

Compound Name2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid
PubChem CID115102549
Molecular FormulaC11H18N2O4
Molecular Weight242.27 g/mol
Exact Mass242.13
IUPAC Name2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid
SMILESO=C(O)C1COC(=O)N1CCN1CCCCC1
InChIInChI=1S/C11H18N2O4/c14-10(15)9-8-17-11(16)13(9)7-6-12-4-2-1-3-5-12/h9H,1-8H2,(H,14,15)
InChIKeyMOIAVZFNDCTOLP-UHFFFAOYSA-N
XLogP0.38
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid?
The IUPAC name of 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid (CID 115102549) is 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid.
What is the SMILES notation for 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid?
The canonical SMILES for 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid is O=C(O)C1COC(=O)N1CCN1CCCCC1.
What is the InChIKey of 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid?
The InChIKey is MOIAVZFNDCTOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4/c14-10(15)9-8-17-11(16)13(9)7-6-12-4-2-1-3-5-12/h9H,1-8H2,(H,14,15).
What are the key properties of 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid?
2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid has a molecular weight of 242.27 g/mol, XLogP of 0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-3-(2-piperidin-1-ylethyl)-1,3-oxazolidine-4-carboxylic acid is sourced from PubChem (CID 115102549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).